CAS 7120-43-6 5-Chloro-2-hydroxybenzamide (HCID 348094)

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Basic information

CAS: 7120-43-6
Standard SMILES: NC(=O)c1cc(Cl)ccc1O
InChIKey: NNHMQZBVJPQCAK-UHFFFAOYSA-N
Molecular formula: C7H6ClNO2
Average molar mass: 171.58 g/mol
Monoisotopic mass: 171.00870611

Overview

structure in first source

Names & identifiers

Preferred name: 5-Chloro-2-hydroxybenzamide
IUPAC: 5-chloro-2-hydroxybenzamide
English name: 5-Chlorosalicylamide
Molecular formula: C7H6ClNO2
Molecular weight: 171.58

Names & synonyms

5-Chlorosalicylamide7120-43-65-Chloro-2-hydroxybenzamideDTXSID40324590RefChem:535014DTXCID10275707620-735-6MFCD000079805-Chloro-2-hydroxy-benzamideNSC4071395chloro-2-hydroxy-benzamideSCHEMBL552216

Show more names

chlorosalicylamideLABOTEST-BB LT004530445-Chlorosalicylamide >5-Chloro-2-hydeoxybenzaMide5-Chloro-2-hydroxybenzamide,97%5-Chlorosalicylamide/5-Chloro-2-hydroxybenzamide

5-Chloro-2-hydroxybenzamide #AKOS000207652NSC-407139C0787W10549Benzamide, 5-chloro-2-hydroxy-5-chlorosalicyl-amideAM804264

Database identifiers

CAS: 7120-43-6
PubChem CID: 348094
DTXSID: DTXSID40324590
ChEMBL: CHEMBL1940495
EC Number: 620-735-6
Nikkaji: J208.213F

Properties

Computed structural properties

XLogP: 2.4
Topological polar surface area: 63.3 Å²
Hydrogen bond donors: 2
Hydrogen bond acceptors: 2
Rotatable bonds: 1
Heavy atoms: 11
Formal charge: 0
Complexity: 163

Physicochemical properties

Melting point: 223 · 223-226 °C(lit.)
storage temp.: Sealed in dry,Room Temperature
form: powder to crystal
color: White to Light yellow
BRN: 743348 · 743348
InChI: InChI=1S/C7H6ClNO2/c8-4-1-2-6(10)5(3-4)7(9)11/h1-3,10H,(H2,9,11)
InChIKey: NNHMQZBVJPQCAK-UHFFFAOYSA-N
SMILES: C(N)(=O)C1=CC(Cl)=CC=C1O
CAS DataBase Reference: 7120 · 7120-43-6(CAS DataBase Reference)
Symbol(GHS): 7 · GHS07
Signal word: Warning
Hazard statements: 315 · H315-H319-H335
Precautionary statements: 261 · P261-P280a-P304+P340-P305+P351+P338-P405-P501a-P264-P280-P302+P352+P332+P313+P362+P364-P305+P351+P338+P337+P313
Hazard Codes: Xi
Risk Statements: 36 · 36/37/38

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)

Aggregated GHS information provided per 46 reports by companies from 5 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.

Hazard information

Regulatory InformationStatus: Active Update: 18-09-2015 https://echa.europa.eu/registration-dossier/-/registered-dossier/16447

Hazard Classes and CategoriesSkin Irrit. 2 (100%)

Safety data

wgk: 3
hs_code: 29242990
risk_code: 36/37/38
Signal word: Warning
Symbol(GHS): GHS07
hazard_code: Xi
safety_code: 26-36-37
hazard_class: IRRITANT
Hazard statements: H315-H319-H335
REACH Registrations: Active
Precautionary statements: P261-P280a-P304+P340-P305+P351+P338-P405-P501a-P264-P280-P302+P352+P332+P313+P362+P364-P305+P351+P338+P337+P313