Basic information
- Standard SMILES
CC(C)c1ccc(NC#N)cc1- InChIKey
BXPLSQXTEDIXAQ-UHFFFAOYSA-N- Molecular formula
- C10H12N2
- Average molar mass
- 160.22 g/mol
Names & identifiers
- Preferred name
- 4-Isopropylphenyl cyanamide
- IUPAC
- (4-propan-2-ylphenyl)cyanamide
Names & synonyms
4-isopropylphenyl cyanamide(4-propan-2-ylphenyl)cyanamide163805-10-5Cyanamide, [4-(1-methylethyl)phenyl]- (9CI)SCHEMBL6158941BXPLSQXTEDIXAQ-UHFFFAOYSA-NAKOS011772996
Database identifiers
- PubChem CID
- 18783174
- Nikkaji
- J1.748.744B
Properties
Computed structural properties
- XLogP
- 3.1
- Topological polar surface area
- 35.8 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 2
- Heavy atoms
- 12
- Formal charge
- 0
- Complexity
- 170
Related reactions
14 records
Compound notes
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