2-[(3-Bromophenyl)carbamoyl]benzoic acid
Completing data — refresh the page later to see the latest
Basic information
- CAS
19336-82-4- Standard SMILES
O=C(O)c1ccccc1C(=O)Nc1cccc(Br)c1- InChIKey
NIHXTMWRAWJTCR-UHFFFAOYSA-N- Molecular formula
- C14H10BrNO3
- Average molar mass
- 320.14 g/mol
- Monoisotopic mass
- 318.98441
Overview
See also: 3'-Bromophthalanilic acid (annotation moved to).
Names & identifiers
- Preferred name
- 2-[(3-Bromophenyl)carbamoyl]benzoic acid
- IUPAC
- 2-[(3-bromophenyl)carbamoyl]benzoic acid
- English name
- 2-[(3-BROMOANILINO)CARBONYL]-BENZOIC ACID
- Molecular formula
- C14H10BrNO3
- Molecular weight
- 320.14
Names & synonyms
2-[(3-bromophenyl)carbamoyl]benzoic acid19336-82-42-[(3-bromoanilino)carbonyl]benzoic acidOprea1_347338Oprea1_5374742-[(3-BROMOANILINO)CARBONYL]-BENZOIC ACIDSCHEMBL7820408DTXSID40357520AKOS002813472DB-3644453'-BROMOPHTHALANILIC ACID3'-BROMOPHTHALANILIC ACID
Show more names
Benzoic acid, 2-[[(3-bromophenyl)amino]carbonyl]-
Database identifiers
- CAS
19336-82-4- PubChem CID
- 853976
- DTXSID
DTXSID40357520
Properties
Computed structural propertiesFilling in
- XLogP
- 3
- Topological polar surface area
- 66.4 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 3
- Heavy atoms
- 19
- Formal charge
- 0
- Complexity
- 348
Physicochemical properties
- Symbol(GHS)
- 7 · GHS07,GHS09
- Signal word
- Warning
- Hazard statements
- 319 · H319-H400-H302
- Precautionary statements
- 264 · P264-P270-P301+P312-P330-P501-P264-P280-P305+P351+P338-P337+P313P-P273-P391-P501
Safety & regulation
Safety information is for reference only and does not replace the supplier’s Safety Data Sheet (SDS), applicable regulations, or professional assessment.
Safety data
- Signal word
- Warning
- Symbol(GHS)
- GHS07,GHS09
- Hazard statements
- H319-H400-H302
- Precautionary statements
- P264-P270-P301+P312-P330-P501-P264-P280-P305+P351+P338-P337+P313P-P273-P391-P501
Related reactions
0 records
No reaction records under the current filter.
Compound notes
Loading…