2-[(4-Chlorophenyl)methylideneamino]benzoic acid
Basic information
- CAS
42027-43-0- Standard SMILES
O=C(O)c1ccccc1N=Cc1ccc(Cl)cc1- InChIKey
HUALPDCOTZUBOD-UHFFFAOYSA-N- Molecular formula
- C14H10ClNO2
- Average molar mass
- 259.69 g/mol
- Monoisotopic mass
- 259.0400063
Names & identifiers
- Preferred name
- 2-[(4-Chlorophenyl)methylideneamino]benzoic acid
- IUPAC
- 2-[(4-chlorophenyl)methylideneamino]benzoic acid
Names & synonyms
42027-43-02-[(4-chlorophenyl)methylideneamino]benzoic acidNSC405394DTXSID10323994NSC-4053942-{(E)-[(4-Chlorophenyl)methylidene]amino}benzoic acid
Database identifiers
- CAS
42027-43-0- PubChem CID
- 346986
- DTXSID
DTXSID10323994
Properties
Computed structural properties
- XLogP
- 3.4
- Topological polar surface area
- 49.7 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 3
- Heavy atoms
- 18
- Formal charge
- 0
- Complexity
- 311
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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