2-Chlorobenzohydrazide

HCID 79883CAS 5814-05-1

Substructure search Find similar structures

Basic information

Standard SMILES: NNC(=O)c1ccccc1Cl
InChIKey: KPPNLSKVTKSSTG-UHFFFAOYSA-N
Molecular formula: C7H7ClN2O
Average molar mass: 170.59 g/mol
Monoisotopic mass: 170.02469052

Names & identifiers

Preferred name: 2-Chlorobenzohydrazide
IUPAC: 2-chlorobenzohydrazide
English name: 2-Chlorobenzhydrazide
Molecular formula: C7H7ClN2O
Molecular weight: 170.6

Names & synonyms

2-Chlorobenzhydrazide2-Chlorobenzohydrazide5814-05-12-Chlorobenzoic acid hydrazide5T829N5VTXNSC 522531NSC-522531DTXSID40206882EINECS 227-380-2O-CHLOROBENZOIC ACID HYDRAZIDERefChem:86454DTXCID70129373

Show more names

orobenzohydrazideTIMTEC-BB SBB0038512-chlorobenzoylhydrazine2-Chlorobenzhydrazide,98%(O-CHLOROBENZOYL)HYDRAZINE2-Chlorobenzohydrazide >

227-380-2KPPNLSKVTKSSTG-UHFFFAOYSA-N2-Chlorobenzoic hydrazide(2-Chlorobenzoyl)hydrazineBenzoic acid, 2-chloro-, hydrazideMFCD00007597o-Chlorobenzhydrazide2ClPhCON2

Database identifiers

CAS: 5814-05-1
PubChem CID: 79883
DTXSID: DTXSID40206882
ChEMBL: CHEMBL3237995
UNII: 5T829N5VTX
EC Number: 227-380-2
Nikkaji: J150.060K

Properties

Computed structural properties

XLogP: 0.1
Topological polar surface area: 55.1 Å²
Hydrogen bond donors: 2
Hydrogen bond acceptors: 2
Rotatable bonds: 1
Heavy atoms: 11
Formal charge: 0
Complexity: 151

Experimental & physicochemical properties

LogP0.14

Physicochemical properties

Melting point: 113 · 113-118 °C
storage temp.: Keep in dark place,Inert atmosphere,Room temperature
form: Crystalline Powder
color: White to slightly beige
BRN: 972229 · 972229
CAS DataBase Reference: 5814 · 5814-05-1(CAS DataBase Reference)
FDA UNII: 5 T829N5VTX · 5T829N5VTX
NIST Chemistry Reference: 2 · 2-Chlorobenzoic acid hydrazide(5814-05-1)
Symbol(GHS): 7 · GHS07
Signal word: Warning
Hazard statements: 335 · H335-H315-H319
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 Statements: 37 · 37/39-26
HazardClass: IRRITANT
HS Code: 29280090 · 29280090

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 47 reports by companies from 7 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.

Hazard information

Hazard Classes and CategoriesSkin Irrit. 2 (100%)

Safety data

hs_code: 29280090
risk_code: 36/37/38
Signal word: Warning
Symbol(GHS): GHS07
hazard_code: Xi
safety_code: 37/39-26
hazard_class: IRRITANT
Hazard statements: H335-H315-H319
Precautionary statements: P261-P280a-P304+P340-P305+P351+P338-P405-P501a-P264-P280-P302+P352+P332+P313+P362+P364-P305+P351+P338+P337+P313