Registration Dossier
Registration Dossier
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EC number: 202-112-7 | CAS number: 91-97-4
Reference substances
- IUPAC name:
- 3,3'-dimethylbiphenyl-4,4'-diyl diisocyanate
Inventory
- EC number:
- 202-112-7
- EC name:
- 3,3'-dimethylbiphenyl-4,4'-diyl diisocyanate
- CAS number:
- 91-97-4
- CAS number:
- 91-97-4
Synonyms
- Names:
- 1,1'-Biphenyl, 4,4'-diisocyanato-3,3'-dimethyl-
- TODI
- Identifier:
- IUPAC name
- 4,4'-diisocyanato-3,3'-dimethylbiphenyl
- Identifier:
- other: SMILES notation
- Cc1cc(ccc1N=C=O)c2ccc(N=C=O)c(C)c2
- Identifier:
- other: InChl
- InChI=1/C16H12N2O2/c1-11-7-13(3-5-15(11)17-9-19)14-4-6-16(18-10-20)12(2)8-14/h3-8H,1-2H3
- 1-isocyanato-4-(4-isocyanato-3-methyl-phenyl)-2-methyl-benzene
Molecular and structural information
- Molecular formula:
- C16H12N2O2
- Molecular weight:
- 264.28
- SMILES notation:
- O=C=N/c1ccc(cc1C)c2ccc(\N=C=O)c(C)c2
- InChl:
- 1/C16H12N2O2/c1-11-7-13(3-5-15(11)17-9-19)14-4-6-16(18-10-20)12(2)8-14/h3-8H,1-2H3
- Structural formula:
Related substances
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