Basic information
- CAS
21132-81-0- Standard SMILES
O=C=Nc1ccccc1Cc1cccc(Cc2ccccc2N=C=O)c1N=C=O- InChIKey
BNOSAGKHYAMZGF-UHFFFAOYSA-N- Molecular formula
- C23H15N3O3
- Average molar mass
- 381.4 g/mol
- Monoisotopic mass
- 381.11134135
Names & identifiers
- Preferred name
- 2,6-Bis(o-isocyanatobenzyl)phenyl isocyanate
- IUPAC
- 2-isocyanato-1,3-bis[(2-isocyanatophenyl)methyl]benzene
- English name
- 2,6-bis(o-isocyanatobenzyl)phenyl isocyanate
- Molecular formula
- C23H15N3O3
- Molecular weight
- 381.38
Names & synonyms
21132-81-02,6-Bis(o-isocyanatobenzyl)phenyl isocyanateEINECS 244-233-8SCHEMBL1396461SCHEMBL29580671DTXSID10943454BNOSAGKHYAMZGF-UHFFFAOYSA-NNS000509731,1'-[(2-Isocyanato-1,3-phenylene)bis(methylene)]bis(2-isocyanatobenzene)2,6-Bis[(2-isocyanatophenyl)methyl]phenyl isocyanate2-Isocyanato-1,3-bis[(2-isocyanatophenyl)methyl]benzeneBenzene, 2-isocyanato-1,3-bis[(2-isocyanatophenyl)methyl]-
Database identifiers
- CAS
21132-81-0- PubChem CID
- 88796
- DTXSID
DTXSID10943454- EC Number
- 244-233-8
- Nikkaji
- J226.146D
Properties
Computed structural properties
- XLogP
- 8.2
- Topological polar surface area
- 88.3 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 6
- Rotatable bonds
- 7
- Heavy atoms
- 29
- Formal charge
- 0
- Complexity
- 629
Chemistry & industry
Suppliers1 total
HONEST JOY HOLDINGS LIMITED[email protected]
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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