2-Amino-5-bromobenzamide

HCID 5019271CAS 16313-66-9

Substructure search Find similar structures

Basic information

Standard SMILES: NC(=O)c1cc(Br)ccc1N
InChIKey: LHAJKJQNMKXZSZ-UHFFFAOYSA-N
Molecular formula: C7H7BrN2O
Average molar mass: 215.05 g/mol
Monoisotopic mass: 213.97417494

Names & identifiers

Preferred name: 2-Amino-5-bromobenzamide
IUPAC: 2-amino-5-bromobenzamide
English name: 2-AMINO-5-BROMOBENZAMIDE
Molecular formula: C7H7BrN2O
Molecular weight: 215.05

Names & synonyms

2-amino-5-bromobenzamide16313-66-9DTXSID40407579RefChem:255672DTXCID40358431845-871-5Benzamide, 2-amino-5-bromo-2-amino-5-bromo-benzamideMFCD040378815-bromanthranilamideSCHEMBL147774AKOS015854785

Show more names

5-Methoxy-phthalicacid2-Amino-5-bromobenzamide ,97%Morphinan-3,14-diol,4,5-epoxy-6-(3,6,9,12,15,18,21-heptaoxadocos-1-yloxy)-17-(2-propen-1-yl)-,(5α,6α)-,ethanedioate(1:6)(salt)

MB03086SY062852Z4249959245-bromoanthranilamideBenzamide,2-amino-5-broFT-0677007CS-W008987GS-3523

Database identifiers

CAS: 16313-66-9
PubChem CID: 5019271
DTXSID: DTXSID40407579
EC Number: 845-871-5
Nikkaji: J2.484.274F

Properties

Computed structural properties

XLogP: 1
Topological polar surface area: 69.1 Å²
Hydrogen bond donors: 2
Hydrogen bond acceptors: 2
Rotatable bonds: 1
Heavy atoms: 11
Formal charge: 0
Complexity: 163

Physicochemical properties

Melting point: 189 · 189-191℃ (water ethanol )
Boiling point: 291.2 · 291.2±25.0℃ (760 Torr)
Density: 1.698 · 1.698±0.06 g/cm3 (20 ºC 760 Torr)
Flash point: 129.9 · 129.9±23.2℃
storage temp.: Keep in dark place,Inert atmosphere,Room temperature
pka: 15.15 · 15.15±0.50(Predicted)
Appearance: White to off-white Solid
Symbol(GHS): 7 · GHS07
Signal word: Warning
Hazard statements: 302 · H302+H312+H332-H315-H319-H335
Precautionary statements: 261 · P261-P280-P305+P351+P338
Hazard Codes: Xi
Risk Statements: 36 · 36/37/38
Safety Statements: 26 · 26-36/37/39
HazardClass: IRRITANT
HS Code: 29242990 · 29242990

Safety & regulation

GHS classification

GHS Classification · 4 items

Warning

H315 (100%): Causes skin irritation [Warning Skin corrosion/irritation]

P261, P264, P264+P265, P271, P280, P302+P352, P304+P340, P305+P351+P338, P319, P321, P332+P317, P337+P317, P362+P364, P403+P233, P405, and P501 (click each P-code to see the statement)

The GHS information provided by 1 company from 1 notification to the ECHA C&L Inventory.