Methyl 4-benzamidobenzoate

HCID 727255
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Basic information

CAS
39799-73-0
Standard SMILES
COC(=O)c1ccc(NC(=O)c2ccccc2)cc1
InChIKey
GPQCAISAMTWGKJ-UHFFFAOYSA-N
Molecular formula
C15H13NO3
Average molar mass
255.27 g/mol
Monoisotopic mass
255.08954328

Names & identifiers

Preferred name
Methyl 4-benzamidobenzoate
IUPAC
methyl 4-benzamidobenzoate
English name
Methyl 4-benzamidobenzoate
Molecular formula
C15H13NO3
Molecular weight
255.27

Names & synonyms

methyl 4-benzamidobenzoate39799-73-0DTXSID70352467RefChem:355585DTXCID90303532Methyl4-benzamidobenzoateMFCD00032222methyl 4-(phenylcarbonylamino)benzoateOprea1_715020SCHEMBL62930GPQCAISAMTWGKJ-UHFFFAOYSA-NKUC112600N
Show more names
Benzoic acid, 4-(benzoylamino)-, methyl ester
AKOS002259142KSC-315-085-A01BS-28338ST029352DB-360966CS-0205888H82144F236492

Database identifiers

CAS
39799-73-0
PubChem CID
727255
DTXSID
DTXSID70352467
Nikkaji
J2.244.870F

Properties

Computed structural properties

XLogP
3.4
Topological polar surface area
55.4 Ų
Hydrogen bond donors
1
Hydrogen bond acceptors
3
Rotatable bonds
4
Heavy atoms
19

Physicochemical properties

Melting point
160 °C · 160 °C
Boiling point
326 · 326.0±25.0 °C(Predicted)
Density
1.237 · 1.237±0.06 g/cm3(Predicted)
storage temp.
2 · 2-8°C
pka
12.94 · 12.94±0.70(Predicted)
Symbol(GHS)
7 · GHS07

Safety & regulation

Safety data

Signal word
Warning
Symbol(GHS)
GHS07
Hazard statements
H302-H315-H319-H335
Precautionary statements
P280-P305+P351+P338

Chemistry & industry

Suppliers12 total

北京福源坊科技有限公司010-57903446 15869909019 · [email protected]
苏州市森菲达化工有限公司18796480002 18796480002 · [email protected]
常州科化生物科技有限公司0519-68985668 13685222090 · [email protected]
烟台正信新材料科技有限公司13854547682 13854547682 · [email protected]
山东李比希生物医药科技有限公司15318973357; 15318973357 · [email protected]

Related reactions

5 records
New reaction record

Compound notes

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