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The new ECHA CHEM database has been released by ECHA, and it now contains all REACH registration data. There are more details on the transition of ECHA's published data to ECHA CHEM here.

Diss Factsheets

Identification

Chemical structure
Display Name:
{1H,4H,5H,6H,7H,8H,9H,10H,11H,12H,13H-cyclopenta[12]annulen-2-yl}methane
EC Number:
941-253-5
CAS Number:
1689576-41-7
Molecular formula:
C16H26
IUPAC Name:
{1H,4H,5H,6H,7H,8H,9H,10H,11H,12H,13H-cyclopenta[12]annulen-2-yl}methane

Type of Substance

Composition:
UVCB
Origin:
organic

Substance Identifiers open all close all

BI000000657492
(No other type specified)

Compositions

Boundary Composition(s) open all close all

State Form:
liquid


Constituent 1
Chemical structure
Reference substance name:
(3aE)-2-methyl-5,6,7,8,9,10,11,12,13,13a-decahydro-1H-cyclopenta[12]annulene
Molecular formula:
C16H26
IUPAC Name:
(3aE)-2-methyl-5,6,7,8,9,10,11,12,13,13a-decahydro-1H-cyclopenta[12]annulene
Constituent 2
Chemical structure
Reference substance name:
2-methyl-4,5,6,7,8,9,10,11,12,13-decahydro-1H-cyclopenta[12]annulene
CAS Number:
77146-09-9
Molecular formula:
C16H26
IUPAC Name:
2-methyl-4,5,6,7,8,9,10,11,12,13-decahydro-1H-cyclopenta[12]annulene
Constituent 3
Chemical structure
Reference substance name:
(13Z)-2-methyl-2,4,5,6,7,8,9,10,11,12-decahydro-1H-cyclopenta[12]annulene
CAS Number:
89328-71-2
Molecular formula:
C16H26
IUPAC Name:
(13Z)-2-methyl-2,4,5,6,7,8,9,10,11,12-decahydro-1H-cyclopenta[12]annulene
Constituent 4
Chemical structure
Reference substance name:
(13E)-2-methyl-3a,4,5,6,7,8,9,10,11,12-decahydro-1H-cyclopenta[12]annulene
CAS Number:
89328-72-3
Molecular formula:
C16H26
IUPAC Name:
(13E)-2-methyl-3a,4,5,6,7,8,9,10,11,12-decahydro-1H-cyclopenta[12]annulene
Constituent 5
Chemical structure
Reference substance name:
(12E)-2-methyl-2,3,4,5,6,7,8,9,10,11-decahydro-1H-cyclopenta[12]annulene
Molecular formula:
C16H26
IUPAC Name:
(12E)-2-methyl-2,3,4,5,6,7,8,9,10,11-decahydro-1H-cyclopenta[12]annulene
Constituent 6
Chemical structure
Reference substance name:
(13Z)-2-methyl-3a,4,5,6,7,8,9,10,11,12-decahydro-1H-cyclopenta[12]annulene
Molecular formula:
C16H26
IUPAC Name:
(13Z)-2-methyl-3a,4,5,6,7,8,9,10,11,12-decahydro-1H-cyclopenta[12]annulene
Constituent 7
Chemical structure
Reference substance name:
2-methyl-2,3,4,5,6,7,8,9,10,11,12,13-dodecahydro-1H-cyclopenta[12]annulene
EC Number:
606-858-8
CAS Number:
21890-09-5
Molecular formula:
C16 H28
IUPAC Name:
2-methyl-2,3,4,5,6,7,8,9,10,11,12,13-dodecahydro-1H-cyclopenta[12]annulene
Constituent 8
Chemical structure
Reference substance name:
(1RS,11RS)-12,12-dimethylbicyclo[9.2.1]tetradecan-14-one
Molecular formula:
C16H28O
IUPAC Name:
(1RS,11RS)-12,12-dimethylbicyclo[9.2.1]tetradecan-14-one
Constituent 9
Chemical structure
Reference substance name:
(2Z)-2-(2-methylpropylidene)cyclododecanone
CAS Number:
1888389-99-8
Molecular formula:
C16H28O
IUPAC Name:
(2Z)-2-(2-methylpropylidene)cyclododecanone
Constituent 10
Chemical structure
Reference substance name:
2-(2-methyl-1-propen-1-yl)cyclododecanone
CAS Number:
134381-40-1
Molecular formula:
C16H28O
IUPAC Name:
2-(2-methyl-1-propen-1-yl)cyclododecanone
Constituent 11
Chemical structure
Reference substance name:
Mixture of 2-(2-methyl-2-propen-1-yl)cyclododecanone and (1RS,11SR)-12,12-dimethylbicyclo[9.2.1]tetradecan-14-one
Molecular formula:
C16H28O
IUPAC Name:
Mixture of 2-(2-methyl-2-propen-1-yl)cyclododecanone and (1RS,11SR)-12,12-dimethylbicyclo[9.2.1]tetradecan-14-one
Constituent 12
Reference substance name:
Unknown constituents
IUPAC Name:
Unknown constituents
State Form:
liquid


Constituent 1
Reference substance name:
non-specified impurities
Molecular formula:
non-specified impurities
IUPAC Name:
non-specified impurities
Constituent 2
Chemical structure
Reference substance name:
Cyclododecanone
EC Number:
212-595-6
EC Name:
Cyclododecanone
CAS Number:
830-13-7
Molecular formula:
C12H22O
IUPAC Name:
cyclododecanone
Constituent 3
Chemical structure
Reference substance name:
2-(2-Methyl-2-propenyl)cyclododecan-1-one
EC Number:
691-657-8
CAS Number:
62599-49-9
Molecular formula:
C16 H28 O
IUPAC Name:
2-(2-Methyl-2-propenyl)cyclododecan-1-one
Constituent 4
Chemical structure
Reference substance name:
Reference substance 001
CAS Number:
1224165-38-1
Molecular formula:
C16 H30 O
Constituent 5
Chemical structure
Reference substance name:
2-Methyl-4,5,6,7,8,9,10,11,12,13-decahydro-1H-cyclopentacyclo-dodecene
CAS Number:
77146-09-9
Molecular formula:
C16 H26
IUPAC Name:
2-Methyl-4,5,6,7,8,9,10,11,12,13-decahydro-1H-cyclopentacyclo-dodecene

Legal Entity Composition(s) open all close all

State Form:
liquid


Constituent 1
Chemical structure
Reference substance name:
(3aE)-2-methyl-5,6,7,8,9,10,11,12,13,13a-decahydro-1H-cyclopenta[12]annulene
Molecular formula:
C16H26
IUPAC Name:
(3aE)-2-methyl-5,6,7,8,9,10,11,12,13,13a-decahydro-1H-cyclopenta[12]annulene
Constituent 2
Chemical structure
Reference substance name:
2-methyl-4,5,6,7,8,9,10,11,12,13-decahydro-1H-cyclopenta[12]annulene
CAS Number:
77146-09-9
Molecular formula:
C16H26
IUPAC Name:
2-methyl-4,5,6,7,8,9,10,11,12,13-decahydro-1H-cyclopenta[12]annulene
Constituent 3
Chemical structure
Reference substance name:
(13Z)-2-methyl-2,4,5,6,7,8,9,10,11,12-decahydro-1H-cyclopenta[12]annulene
CAS Number:
89328-71-2
Molecular formula:
C16H26
IUPAC Name:
(13Z)-2-methyl-2,4,5,6,7,8,9,10,11,12-decahydro-1H-cyclopenta[12]annulene
Constituent 4
Chemical structure
Reference substance name:
(13E)-2-methyl-3a,4,5,6,7,8,9,10,11,12-decahydro-1H-cyclopenta[12]annulene
CAS Number:
89328-72-3
Molecular formula:
C16H26
IUPAC Name:
(13E)-2-methyl-3a,4,5,6,7,8,9,10,11,12-decahydro-1H-cyclopenta[12]annulene
Constituent 5
Chemical structure
Reference substance name:
(12E)-2-methyl-2,3,4,5,6,7,8,9,10,11-decahydro-1H-cyclopenta[12]annulene
Molecular formula:
C16H26
IUPAC Name:
(12E)-2-methyl-2,3,4,5,6,7,8,9,10,11-decahydro-1H-cyclopenta[12]annulene
Constituent 6
Chemical structure
Reference substance name:
(13Z)-2-methyl-3a,4,5,6,7,8,9,10,11,12-decahydro-1H-cyclopenta[12]annulene
Molecular formula:
C16H26
IUPAC Name:
(13Z)-2-methyl-3a,4,5,6,7,8,9,10,11,12-decahydro-1H-cyclopenta[12]annulene
Constituent 7
Chemical structure
Reference substance name:
2-methyl-2,3,4,5,6,7,8,9,10,11,12,13-dodecahydro-1H-cyclopenta[12]annulene
EC Number:
606-858-8
CAS Number:
21890-09-5
Molecular formula:
C16 H28
IUPAC Name:
2-methyl-2,3,4,5,6,7,8,9,10,11,12,13-dodecahydro-1H-cyclopenta[12]annulene
Constituent 8
Chemical structure
Reference substance name:
(1RS,11RS)-12,12-dimethylbicyclo[9.2.1]tetradecan-14-one
Molecular formula:
C16H28O
IUPAC Name:
(1RS,11RS)-12,12-dimethylbicyclo[9.2.1]tetradecan-14-one
Constituent 9
Chemical structure
Reference substance name:
(2Z)-2-(2-methylpropylidene)cyclododecanone
CAS Number:
1888389-99-8
Molecular formula:
C16H28O
IUPAC Name:
(2Z)-2-(2-methylpropylidene)cyclododecanone
Constituent 10
Chemical structure
Reference substance name:
2-(2-methyl-1-propen-1-yl)cyclododecanone
CAS Number:
134381-40-1
Molecular formula:
C16H28O
IUPAC Name:
2-(2-methyl-1-propen-1-yl)cyclododecanone
Constituent 11
Chemical structure
Reference substance name:
Mixture of 2-(2-methyl-2-propen-1-yl)cyclododecanone and (1RS,11SR)-12,12-dimethylbicyclo[9.2.1]tetradecan-14-one
Molecular formula:
C16H28O
IUPAC Name:
Mixture of 2-(2-methyl-2-propen-1-yl)cyclododecanone and (1RS,11SR)-12,12-dimethylbicyclo[9.2.1]tetradecan-14-one
Constituent 12
Reference substance name:
Unknown constituents
IUPAC Name:
Unknown constituents
State Form:
liquid


Constituent 1
Reference substance name:
non-specified impurities
Molecular formula:
non-specified impurities
IUPAC Name:
non-specified impurities
Constituent 2
Chemical structure
Reference substance name:
Cyclododecanone
EC Number:
212-595-6
EC Name:
Cyclododecanone
CAS Number:
830-13-7
Molecular formula:
C12H22O
IUPAC Name:
cyclododecanone
Constituent 3
Chemical structure
Reference substance name:
2-(2-Methyl-2-propenyl)cyclododecan-1-one
EC Number:
691-657-8
CAS Number:
62599-49-9
Molecular formula:
C16 H28 O
IUPAC Name:
2-(2-Methyl-2-propenyl)cyclododecan-1-one
Constituent 4
Chemical structure
Reference substance name:
Reference substance 001
CAS Number:
1224165-38-1
Molecular formula:
C16 H30 O
Constituent 5
Chemical structure
Reference substance name:
2-Methyl-4,5,6,7,8,9,10,11,12,13-decahydro-1H-cyclopentacyclo-dodecene
CAS Number:
77146-09-9
Molecular formula:
C16 H26
IUPAC Name:
2-Methyl-4,5,6,7,8,9,10,11,12,13-decahydro-1H-cyclopentacyclo-dodecene

Composition(s) generated upon use

Other types of composition(s)