Benzoic acid, 5-chloro-3-ethyl-2-hydroxy-
Basic information
- CAS
53347-09-4- Standard SMILES
CCc1cc(Cl)cc(C(=O)O)c1O- InChIKey
AWOQTWNNQUVGAG-UHFFFAOYSA-N- Molecular formula
- C9H9ClO3
- Average molar mass
- 200.62 g/mol
- Monoisotopic mass
- 200.0240218
Names & identifiers
- Preferred name
- Benzoic acid, 5-chloro-3-ethyl-2-hydroxy-
- IUPAC
- 5-chloro-3-ethyl-2-hydroxybenzoic acid
- English name
- 5-Chloro-3-ethyl-2-hydroxybenzoic acid
- Molecular formula
- C9H9ClO3
- Molecular weight
- 200.62
Names & synonyms
5-Chloro-3-ethyl-2-hydroxybenzoic acidBRN 272113853347-09-4BENZOIC ACID, 5-CHLORO-3-ETHYL-2-HYDROXY-DTXSID10201501RefChem:327680DTXCID70123992SCHEMBL14564097SCHEMBL30810293DB-306651
Database identifiers
- CAS
53347-09-4- PubChem CID
- 40739
- DTXSID
DTXSID10201501- Nikkaji
- J87.179F
Properties
Computed structural properties
- XLogP
- 3.1
- Topological polar surface area
- 57.5 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 2
- Heavy atoms
- 13
- Formal charge
- 0
- Complexity
- 195
Suppliers
Loading…
Open inquiries
Loading…
Related reactions
0 records
No reaction records under the current filter.
Compound notes
Loading…