Basic information
- CAS
75175-79-0- Standard SMILES
CN(C)C=CC(=O)c1cccc(Cl)c1- InChIKey
LDBZHHVGVAIVBT-UHFFFAOYSA-N- Molecular formula
- C11H12ClNO
- Average molar mass
- 209.67 g/mol
- Monoisotopic mass
- 209.06074168
Names & identifiers
- Preferred name
- 1-(3-Chlorophenyl)-3-(dimethylamino)-2-propen-1-one
- IUPAC
- 1-(3-chlorophenyl)-3-(dimethylamino)prop-2-en-1-one
- English name
- AKOS B029583
- Molecular formula
- C11H12ClNO
- Molecular weight
- 209.67
Names & synonyms
75175-79-01-(3-chlorophenyl)-3-(dimethylamino)-2-propen-1-one1-(3-chlorophenyl)-3-(dimethylamino)prop-2-en-1-one2-Propen-1-one, 1-(3-chlorophenyl)-3-(dimethylamino)-MFCD08558193SCHEMBL2949411LDBZHHVGVAIVBT-UHFFFAOYSA-NDTXSID7012238263'-chloro-3-dimethylaminoacrylophenoneAKOS017382203AKOS B029583(Z)-1-(3-chlorophenyl)-3-dimethylaminoprop-2-en-1-one
Show more names
(Z)-1-(3-chlorophenyl)-3-dimethylamino-prop-2-en-1-one(2E)-1-(3-chlorophenyl)-3-(dimethylamino)prop-2-en-1-one
Database identifiers
- CAS
75175-79-0- PubChem CID
- 730065
- DTXSID
DTXSID701223826
Properties
Computed structural properties
- XLogP
- 2.9
- Topological polar surface area
- 20.3 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 3
- Heavy atoms
- 14
- Formal charge
- 0
- Complexity
- 225
Chemistry & industry
Suppliers1 total
珠海奥博凯生物医药技术有限公司400-0628126 · [email protected]
Related reactions
3 records
Compound notes
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