Basic information
- Standard SMILES
COc1cc(C(C)=O)ccc1OC/C=C\CCl- InChIKey
ZWQJFADJLYSBMG-ARJAWSKDSA-N- Molecular formula
- C13H15ClO3
- Average molar mass
- 254.71 g/mol
Names & identifiers
- Preferred name
- (Z)-1-[4-[(4-chloro-2-butenyl)oxy]-3-methoxyphenyl]ethanone
- IUPAC
- 1-[4-[(Z)-4-chlorobut-2-enoxy]-3-methoxyphenyl]ethanone
Names & synonyms
SCHEMBL1545265ZWQJFADJLYSBMG-ARJAWSKDSA-N(Z)-1-[4-[(4-chloro-2-butenyl)oxy]-3-methoxyphenyl]ethanone(z)-1-[4-[(4chloro-2-butenyl)oxy]-3-methoxyphenyl]ethanone(Z)-1-[4[(4-chloro-2-butenyl)oxy]-3-methoxy-phenyl]ethanone(z)-1-[4[(4-chloro-2-butenyl)oxy]-3-methoxyphenyl]ethanone(Z)-1-[4[(4chloro-2-butenyl)oxy]-3-methoxyphenyl]ethanone
Database identifiers
- PubChem CID
- 57454977
Properties
Computed structural properties
- XLogP
- 2.4
- Topological polar surface area
- 35.5 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 6
- Heavy atoms
- 17
- Formal charge
- 0
- Complexity
- 265
Related reactions
74 records
Linked notes
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