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Please be aware that this old REACH registration data factsheet is no longer maintained; it remains frozen as of 19th May 2023.

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

Reference substances

Reference substances

Currently viewing:
IUPAC name:
Reaction mass of 1,1'-methylenebis(4-isocyanatobenzene) and 1-isocyanato-2-(4-isocyanatobenzyl)benzene

Inventory

Synonyms
Names:
Identifier:
EC number
905-806-4
Identifier:
IUPAC name
1,1'-methanediylbis(4-isocyanatobenzene) 1-isocyanato-2-(4-isocyanatobenzyl)benzene
Identifier:
IUPAC name
Reaction mass of 4,4'-methylenediphenyl diisocyanate and o-(p-isocyanatobenzyl)phenyl isocyanate
Identifier:
IUPAC name
Reaction mass of 4,4'-methylenediphenyl diisocyanate and o-(p-isocyanatobenzyl)phenyl isocyanate / methylene diphenyl diisocyanate
Identifier:
other: Molecular formula
C14 H8 O2 N2
Identifier:
other: Molecular formula
C15 H10 N2 O2
Identifier:
other: Molecular formula
C15H10N2O2 C15H10N2O2
Identifier:
other: InChl
InChI=1/C15H10N2O2/c18-10-16-14-5-1-12(2-6-14)9-13-3-7-15(8-4-13)17-11-19/h1-8H,9H2InChI=1/C15H10N2O2/c18-10-16-14-7-5-12(6-8-14)9-13-3-1-2-4-15(13)17-11-19/h1-8H,9H2
Identifier:
other: SMILES notation
O=C=NC1CCCC(CC1)CC2CCCC(C2)N=C=O
Identifier:
other: SMILES notation
O=C=Nc1ccc(Cc2ccc(cc2)N=C=O)cc1O=C=Nc1ccc(Cc2ccccc2N=C=O)cc1

Molecular and structural information

Molecular formula:
C15 H10 N2 O2
Molecular weight:
ca. 250
SMILES notation:
O=C=Nc1ccc(Cc2ccc(cc2)N=C=O)cc1

O=C=Nc1ccc(Cc2ccccc2N=C=O)cc1
InChl:
InChI=1/C15H10N2O2/c18-10-16-14-5-1-12(2-6-14)9-13-3-7-15(8-4-13)17-11-19/h1-8H,9H2

InChI=1/C15H10N2O2/c18-10-16-14-7-5-12(6-8-14)9-13-3-1-2-4-15(13)17-11-19/h1-8H,9H2
Structural formula:
Chemical structure

Related substances

open allclose all
Identifier:
EC number
Identity:
247-714-0
Identifier:
CAS number
Identity:
26447-40-5