Basic information
- CAS
4172-91-2- Standard SMILES
CN=C=Nc1ccccc1- InChIKey
RLEKTPHUQPAOAF-UHFFFAOYSA-N- Molecular formula
- C8H8N2
- Average molar mass
- 132.16 g/mol
- Monoisotopic mass
- 132.06874826
Names & identifiers
- Preferred name
- N-Methyl-N'-phenylcarbodiimide
- IUPAC
- N-methyl-N'-phenylmethanediimine
Names & synonyms
N-Methyl-N'-phenylcarbodiimide4172-91-2DTXSID40194518RefChem:364523DTXCID80117009N-methyl-N'-phenylmethanediiminemethylphenylcarbodiimideSCHEMBL1535350N'-methyl-N-phenylmethanediimineRLEKTPHUQPAOAF-UHFFFAOYSA-N
Database identifiers
- CAS
4172-91-2- PubChem CID
- 138144
- DTXSID
DTXSID40194518- Nikkaji
- J627.511G
Properties
Computed structural properties
- XLogP
- 2.9
- Topological polar surface area
- 24.7 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 1
- Heavy atoms
- 10
- Formal charge
- 0
- Complexity
- 139
Related reactions
2 records
Compound notes
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