3-(3,3-Dichloroallyl)-8-methoxy-2-methylquinolin-4-ol
Basic information
- CAS
67629-20-3- Standard SMILES
COc1cccc2c(=O)c(CC=C(Cl)Cl)c(C)[nH]c12- InChIKey
JEDKXMIBULUSGQ-UHFFFAOYSA-N- Molecular formula
- C14H13Cl2NO2
- Average molar mass
- 298.2 g/mol
- Monoisotopic mass
- 297.032334
Names & identifiers
- Preferred name
- 3-(3,3-Dichloroallyl)-8-methoxy-2-methylquinolin-4-ol
- IUPAC
- 3-(3,3-dichloroprop-2-enyl)-8-methoxy-2-methyl-1H-quinolin-4-one
Names & synonyms
67629-20-33-(3,3-Dichloroallyl)-8-methoxy-2-methylquinolin-4-ol3-(3,3-dichloroprop-2-en-1-yl)-8-methoxy-2-methylquinolin-4-ol4-Quinolinol, 3-(3,3-dichloro-2-propenyl)-8-methoxy-2-methyl-DTXSID603539833-(3,3-dichloroprop-2-enyl)-8-methoxy-2-methyl-1H-quinolin-4-oneSTK037514AKOS001722903SB70488AG-205/11956999SR-01000220129SR-01000220129-1
Show more names
3-(3,3-dichloro-2-propenyl)-8-methoxy-2-methyl-4-quinolinol3-(3,3-dichloro-2-propen-1-yl)-8-methoxy-2-methyl-4-quinolinol3-(3,3-Dichloroprop-2-en-1-yl)-8-methoxy-2-methylquinolin-4(1H)-one
Database identifiers
- CAS
67629-20-3- PubChem CID
- 760768
- DTXSID
DTXSID60353983
Properties
Computed structural properties
- XLogP
- 4.1
- Topological polar surface area
- 38.3 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 3
- Heavy atoms
- 19
- Formal charge
- 0
- Complexity
- 427
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