Completing data — usually done within a minute
Basic information
- CAS
101-39-3- Standard SMILES
CC(C=O)=Cc1ccccc1- InChIKey
VLUMOWNVWOXZAU-UHFFFAOYSA-N- Molecular formula
- C10H10O
- Average molar mass
- 146.19 g/mol
- Monoisotopic mass
- 146.07316494
Names & identifiers
- Preferred name
- 2-Methylcinnamic aldehyde
- IUPAC
- 2-methyl-3-phenylprop-2-enal
Names & synonyms
2-methylcinnamic aldehydeDTXSID4025587DTXCID705587RefChem:1063802methylcinnamaldehyde2-methyl-3-phenyl-prop-2-enala-MethylcinnamaldehydeZ-alpha-Methylcinnamaldehydea-methyl cinnamaldehydealpha-methyl-cinnamaldehyde2-methyl-3-phenyl-propenalSCHEMBL143643
Show more names
SCHEMBL230809CHEMBL3184118SCHEMBL282537343-phenyl-2-methyl-prop-2-enalVLUMOWNVWOXZAU-UHFFFAOYSA-N
Database identifiers
- CAS
101-39-3- PubChem CID
- 7557
- DTXSID
DTXSID4025587- ChEMBL
CHEMBL3184118
Properties
Computed structural propertiesFilling in
- XLogP
- 2.2
- Topological polar surface area
- 17.1 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 1
- Rotatable bonds
- 2
- Heavy atoms
- 11
- Formal charge
- 0
- Complexity
- 152
Experimental & physicochemical properties
SpringerMaterials PropertiesBoiling point
Related reactions
18 records
Compound notes
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