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Reference substances

Reference substances

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General information

Inventory

EC number:
202-422-2
EC name:
o-xylene
CAS number:
95-47-6

No inventory information available

Reference substance information

IUPAC name:
o-xylene
Synonyms
Names:
1,2-Dimethylbenzene
1,2-Dimethylbenzol
1,2-Xylene
1,2-xylene
1330-20-7
2-Methyltoluene
2-xylene
3,4-Dimethylbenzene
3,4-xylene
BENZENE,1,2-DIMETHYL
Benzene, 1,2-dimethyl-
Benzene, o-dimethyl-
C.I. Oxidation Base 16
IK 3
METHYLTOLUENE
Mott-Ex
Mottenschutzmittel Evau P
O-XYLOL
ORTHO-XYLENE
OXE
Rotamott
UN 1307
XYLENE, O
XYLENE, ORTHO-
Xylene, o-
Xylol
o-Dimethylbenzene
o-Methyltoluene
o-Xylenes
o-xylol
o-xylol 2-methyltoluene o-xylene 1,2-dimethylbenzene
orthoxylene
Identifier:
EC name
xylene
Identifier:
IUPAC name
1,2-Dimethylbenzene
Identifier:
IUPAC name
1,2-dimethylbenzene
Identifier:
IUPAC name
1,2-xylene
Identifier:
IUPAC name
Ortho-Xylene
Identifier:
other: InChl
1/C8H10/c1-7-5-3-4-6-8(7)2/h3-6H1-2H3
Identifier:
other: InChl
1S/C8H10/c1-7-5-3-4-6-8(7)2/h3-6H,1-2H3 Y Key: CTQNGGLPUBDAKN-UHFFFAOYSA-N Y
Identifier:
other: SMILES notation
CC1=C(C)C=CC=C1
Identifier:
other: SMILES notation
CC1=CC=CC=C1C
Identifier:
other: SMILES notation
Cc1c(C)cccc1
Identifier:
other: InChl
InChI=1S/C8H10/c1-7-5-3-4-6-8(7)2/h3-6H,1-2H3 AuxInfo=1/0/N:7,8,3,4,2,5,1,6/E:(1,2)(3,4)(5,6)(7,8)/rA:8CCCCCCCC/rB:d-1;s2;d-3;s4;s1d-5;s1;s6;/rC:2.2945,-1.3655,0;3.1115,-2.671,0;2.3266,-3.9805,0;.7849,-3.9805,0;0,-2.671,0;.8169,-1.3655,0;3.0875,0,0;.0842,0,0;

CAS information

CAS number:
95-47-6

Related substances

Identifiers of related substancesopen allclose all
Identifier:
CAS number
Identity:
1330-20-7
Identifier:
CAS number
Identity:
106-42-3
Identifier:
CAS number
Identity:
108-38-3

Molecular and structural information

Molecular formula:
C8H10
Molecular weight:
106.165
SMILES notation:
Cc1ccccc1C
InChl:
InChI=1/C8H10/c1-7-5-3-4-6-8(7)2/h3-6H,1-2H3
Structural formula:
Chemical structure