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Benzamide, N-(4-amino-5-chloro-2-methoxyphenyl)-

HCID 80727
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Basic information

CAS
6368-90-7
Standard SMILES
COc1cc(N)c(Cl)cc1NC(=O)c1ccccc1
InChIKey
VIUTVHGOAOMQHY-UHFFFAOYSA-N
Molecular formula
C14H13ClN2O2
Average molar mass
276.72 g/mol
Monoisotopic mass
276.0665554

Names & identifiers

Preferred name
Benzamide, N-(4-amino-5-chloro-2-methoxyphenyl)-
IUPAC
N-(4-amino-5-chloro-2-methoxyphenyl)benzamide
English name
CI NO 7160
Molecular formula
C14H13ClN2O2
Molecular weight
276.72

Names & synonyms

Benzamide, N-(4-amino-5-chloro-2-methoxyphenyl)-6368-90-7EINECS 228-863-0DTXSID9064267RefChem:561556DTXCID8044046n-(4-amino-5-chloro-2-methoxyphenyl)benzamideEQZ59TPR3T4'-Amino-5'-chloro-2'-methoxybenzanilideMLS000105609UNII-EQZ59TPR3TCambridge id 5302535
Show more names
CI NO 7160C.I.37160(base)Fast Corinth Base DFAST CORINTH LB SALTFast Corinth AM Basefast corinth LB baseFast Corinth Base LBAzoic Diazo Component 43Azoic diazo 43 (C.I. 37160)
Oprea1_847551SCHEMBL8777761CHEMBL1320142VIUTVHGOAOMQHY-UHFFFAOYSA-NHMS2427M10SMR000102587NS00021278AB00079442-01

Database identifiers

CAS
6368-90-7
PubChem CID
80727
DTXSID
DTXSID9064267
ChEMBL
CHEMBL1320142
UNII
EQZ59TPR3T
EC Number
228-863-0
Nikkaji
J206.964D

Properties

Computed structural properties

XLogP
2.7
Topological polar surface area
64.4 Ų
Hydrogen bond donors
2
Hydrogen bond acceptors
3
Rotatable bonds
3
Heavy atoms
19
Formal charge
0
Complexity
308

Physicochemical properties

Melting point
152.5 °C · 152.5 °C
Boiling point
360.6 · 360.6±42.0 °C(Predicted)
Density
1.339 · 1.339±0.06 g/cm3(Predicted)
pka
11.84 · 11.84±0.70(Predicted)
FDA UNII
59 TPR3T · EQZ59TPR3T
EPA Substance Registry System
Benzamide, N-(4-amino-5-chloro-2-methoxyphenyl)- (6368-90-7)
TSCA
TSCA listed

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

tsca
TSCA listed

Chemistry & industry

Uses & manufacturing

General Manufacturing InformationBenzamide, N-(4-amino-5-chloro-2-methoxyphenyl)-: INACTIVE

Preparation methods

PreparationN-(5-chloro-2-rnethoxyphenyl)formamide and hydrolysis into 2′-Methoxy-4′-amino-5,-chlorobenzanilide, and Benzoyl chloridecondensation, and then reduction (BIOS 1149)

Upstream & downstream products

Upstream raw materials

CI NO 7160Benzoyl chloride

Downstream products

CI NO 7160

Related reactions

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Compound notes

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