Basic information
- Standard SMILES
C/C(C#N)=C1\c2ccccc2CCc2cc(CO)ccc21- InChIKey
JDMUTMGMSWEBIA-UYRXBGFRSA-N- Molecular formula
- C19H17NO
- Average molar mass
- 275.3 g/mol
Names & identifiers
- Preferred name
- (Z)-2-(2-hydroxymethyl-10,11-dihydro-5H-dibenzo[a,d]cyclohepten-5-ylidene)propiononitrile
- IUPAC
- (2Z)-2-[6-(hydroxymethyl)-2-tricyclo[9.4.0.03,8]pentadeca-1(15),3(8),4,6,11,13-hexaenylidene]propanenitrile
Names & synonyms
SCHEMBL1916990JDMUTMGMSWEBIA-UYRXBGFRSA-N(Z)-2-(2-hydroxymethyl-10,11-dihydro-5H-dibenzo[a,d]cyclohepten-5-ylidene)propiononitrile
Database identifiers
- PubChem CID
- 67210308
Properties
Computed structural properties
- XLogP
- 3.1
- Topological polar surface area
- 44 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 1
- Heavy atoms
- 21
- Formal charge
- 0
- Complexity
- 457
Related reactions
3 records
Compound notes
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