Basic information
- CAS
7510-49-8- Standard SMILES
COC(=O)c1ccccc1NC(=O)c1ccccc1- InChIKey
NOMUELNZAGGIDL-UHFFFAOYSA-N- Molecular formula
- C15H13NO3
- Average molar mass
- 255.27 g/mol
- Monoisotopic mass
- 255.08954328
Names & identifiers
- Preferred name
- Methyl 2-benzamidobenzoate
- IUPAC
- methyl 2-benzamidobenzoate
- English name
- Methyl N-benzoylanthranilate
- Molecular formula
- C15H13NO3
- Molecular weight
- 255.27
Names & synonyms
methyl 2-benzamidobenzoate7510-49-82-BENZOYLAMINO-BENZOIC ACID METHYL ESTERMethyl 2-benzoylaminobenzoateMFCD00089143methyl 2-(benzoylamino)benzoateNSC405693methyl 2-[(phenylcarbonyl)amino]benzoatemethyl2-benzamidobenzoateMaybridge1_000305Oprea1_202471Oprea1_233405
Show more names
Benzoic acid, 2-(benzoylamino)-, methyl ester
SCHEMBL11665959HMS542F19DTXSID40324090METHYL N-BENZOYLANTHRANILATECCG-45973STK010446AKOS001627634methyl 2-(phenylcarbonylamino)benzoate
Database identifiers
- CAS
7510-49-8- PubChem CID
- 347181
- DTXSID
DTXSID40324090- EC Number
- 688-709-7
- Nikkaji
- J31.004B
Properties
Computed structural properties
- XLogP
- 3.3
- Topological polar surface area
- 55.4 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 4
- Heavy atoms
- 19
- Formal charge
- 0
- Complexity
- 323
Physicochemical properties
- Melting point
- 101 °C · 101 °C(Solv: ligroine (8032-32-4))
- Boiling point
- 324.3 · 324.3±25.0 °C(Predicted)
- Density
- 1.237 · 1.237±0.06 g/cm3(Predicted)
- pka
- 12.9 · 12.90±0.70(Predicted)
- Symbol(GHS)
- 9 · GHS09
- Signal word
- Warning
- Hazard statements
- 400 · H400
- Precautionary statements
- 273 · 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
H400 (100%): Very toxic to aquatic life [Warning Hazardous to the aquatic environment, acute hazard]
P273, 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.
Hazard information
Hazard Classes and CategoriesAquatic Acute 1 (100%)
Safety data
- Signal word
- Warning
- Symbol(GHS)
- GHS09
- Hazard statements
- H400
- Precautionary statements
- P273-P391-P501
Chemistry & industry
Suppliers21 total
陕西格列弗生物科技研究有限责任公司18409274651; 13892423764 · [email protected]
北京福源坊科技有限公司010-57903446 15869909019 · [email protected]
江苏艾康生物医药研发有限公司025-58851090 19370895928 · [email protected]
咸宁深蓝生物医药研发有限公司18171815831 · [email protected]
郑州汇聚化工有限公司13393710386 · [email protected]
湖北科乐精细化工有限公司027-59101668 19945030958 · [email protected]
山东利腾生物科技有限公司+86-18663721413 +86-15552573001 · [email protected]
欧利希（湖北）医药科技有限公司17316404525 17316404525 · [email protected]
Sigma-Aldrich西格玛奥德里奇(上海)贸易有限公司021-61415566 800-8193336 · [email protected]
武汉德拜技术有限公司18086626237 18086626237 · [email protected]
北京建强伟业科技有限公司（FUSION弗珍试剂品牌）0531-88924771 15614660963 · [email protected]
上海昂提生物科技有限公司13764913901 · [email protected]
哈辉（上海）医药技术有限公司021-13472633-721 13472633721 · [email protected]
河南伊诺凯新材料有限公司15565215982 15565215982 · [email protected]
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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