2'-Methylphthalanilic acid
Basic information
- CAS
19336-68-6- Standard SMILES
Cc1ccccc1NC(=O)c1ccccc1C(=O)O- InChIKey
ZLFQPNGPGDNBNH-UHFFFAOYSA-N- Molecular formula
- C15H13NO3
- Average molar mass
- 255.27 g/mol
- Monoisotopic mass
- 255.08954328
Names & identifiers
- Preferred name
- 2'-Methylphthalanilic acid
- IUPAC
- 2-[(2-methylphenyl)carbamoyl]benzoic acid
- English name
- 2'-Methylphthalanilic acid
- Molecular formula
- C15H13NO3
- Molecular weight
- 255.27
Names & synonyms
19336-68-62'-Methylphthalanilic acidRefChem:439715660-117-32-(o-tolylcarbamoyl)benzoic acid2-[(2-methylphenyl)carbamoyl]benzoic acid2-(2-toluidinocarbonyl)benzoic acidOprea1_311427Oprea1_7935452-(o-tolylcarbamoyl)benzoicacidSCHEMBL11289021N(o-TOLYL)PHTHALIMIDIC ACID
Show more names
2-(2-MethylphenylcarbaMoyl)benzoic acid, 97%2-[[(2-Methylphenyl)amino]carbonyl]benzoic acidBenzoic acid, 2-[[(2-methylphenyl)amino]carbonyl]-
STK391771AKOS0012868772-[N-(2-methylphenyl)carbamoyl]benzoic acidST50170890AQ-360/06457009SR-01000392384SR-01000392384-1Z90422798
Database identifiers
- CAS
19336-68-6- PubChem CID
- 765198
- EC Number
- 660-117-3
- Nikkaji
- J847.694B
Properties
Computed structural properties
- XLogP
- 2.6
- 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
- 342
Physicochemical properties
- Melting point
- 170 °C · 170 °C
- Boiling point
- 366.9 · 366.9±35.0 °C(Predicted)
- Density
- 1.295 · 1.295±0.06 g/cm3(Predicted)
- pka
- 3.45 · 3.45±0.36(Predicted)
- Symbol(GHS)
- 7 · GHS07,GHS09
- Signal word
- Warning
- Hazard statements
- 319 · H319-H400-H302
- Precautionary statements
- 264 · P264-P280-P305+P351+P338-P337+P313P-P264-P270-P301+P312-P330-P501-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.
GHS classification
GHS Classification
Warning
H302 (100%): Harmful if swallowed [Warning Acute toxicity, oral]
P264, P264+P265, P270, P273, P280, P301+P317, P305+P351+P338, P330, P337+P317, P391, and P501 (click each P-code to see the statement)
Aggregated GHS information provided per 39 reports by companies from 1 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.
Hazard information
Hazard Classes and CategoriesAcute Tox. 4 (100%)
Safety data
- Signal word
- Warning
- Symbol(GHS)
- GHS07,GHS09
- Hazard statements
- H319-H400-H302
- Precautionary statements
- P264-P280-P305+P351+P338-P337+P313P-P264-P270-P301+P312-P330-P501-P273-P391-P501
Chemistry & industry
Upstream & downstream products
Upstream raw materials
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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