Basic information
- Standard SMILES
O=C(N=C=S)C1(c2ccccc2)CC1- InChIKey
SRJBKVJKZBNVOV-UHFFFAOYSA-N- Molecular formula
- C11H9NOS
- Average molar mass
- 203.26 g/mol
Names & identifiers
- Preferred name
- 1-Phenylcyclopropanecarbonyl isothiocyanate
- IUPAC
- 1-phenylcyclopropane-1-carbonyl isothiocyanate
Names & synonyms
SCHEMBL3569399SRJBKVJKZBNVOV-UHFFFAOYSA-NAKOS0121777251-phenylcyclopropanecarbonyl isothiocyanate
Database identifiers
- PubChem CID
- 21890610
Properties
Computed structural properties
- XLogP
- 3.5
- Topological polar surface area
- 61.5 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 2
- Heavy atoms
- 14
- Formal charge
- 0
- Complexity
- 284
Related reactions
3 records
Compound notes
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