2-[ (4-Chlorophenyl) thio]acetohydrazide

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CAS Number

75150-40-2

MDL Number

MFCD01176459

Purity

=95%

Smiles

NNC(=O)CSc1ccc(Cl)cc1

Chemical Information

2-[(4-Chlorophenyl)sulfanyl]acetohydrazide

CAS Number	75150-40-2
PubChem CID	734893
IUPAC Name	2-(4-chlorophenyl)sulfanylacetohydrazide
Molecular Formula	C8H9ClN2OS
Molecular Weight	216.69
XLogP	1.7
Topological Polar Surface Area	80.4
Hydrogen Bond Donor Count	2
Hydrogen Bond Acceptor Count	3
Rotatable Bond Count	3
Heavy Atom Count	13
Formal Charge	0
Complexity	172

SMILES

C1=CC(=CC=C1SCC(=O)NN)Cl

InChI

InChI=1S/C8H9ClN2OS/c9-6-1-3-7(4-2-6)13-5-8(12)11-10/h1-4H,5,10H2,(H,11,12)

InChIKey

SXJWSRUPDZKESM-UHFFFAOYSA-N

Chemical Structure

2D Structure

CAS: 75150-40-2

CID: 734893

Formula: C8H9ClN2OS

MW: 216.69

Interactive 3D Structure

Loading 3D structure...

Computed Properties

Property	Value
Molecular Weight	216.69
XLogP3	1.7
Hydrogen Bond Donor Count	2
Hydrogen Bond Acceptor Count	3
Rotatable Bond Count	3
Exact Mass	216.0124118
Monoisotopic Mass	216.0124118
Topological Polar Surface Area	80.4 Å²
Heavy Atom Count	13
Formal Charge	0
Complexity	172
Isotope Atom Count	0
Defined Atom Stereocenter Count	0
Undefined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Undefined Bond Stereocenter Count	0
Covalently-Bonded Unit Count	1
Compound Is Canonicalized	Yes

Catalog	Name
OR1063164-01	2- (4-Chlorophenyl) acetohydrazide
OR1052026-01	2- ((4-Chlorobenzyl) thio) acetohydrazide
OR95866-01	2- (2-Chlorophenyl) acetohydrazide
OR8064	2-[ (7-Chloroquinolin-4-yl) thio]acetohydrazide
OR1063152	2- (3-Chlorophenyl) acetohydrazide
OR21711	2-[ (4-chlorophenyl) thio]nicotinamide
OR25197-01	2-[ (4-Chlorophenyl) thio]benzaldehyde
OR15484-01	2-[ (4-Chlorophenyl) thio]ethanol
OR25441	2-[ (4-chlorophenyl) thio]thiophene
OR91484	2- ((4-Chlorophenyl) thio) aniline

Catalog	Name
413717-01	2- (4-Chlorophenyl) acetohydrazide
sc-321366	2-[ (4-Fluorobenzyl) thio]acetohydrazide
sc-274102	2-[ (4-methylphenyl) thio]acetohydrazide
sc-321329	2-[ (4-Bromobenzyl) thio]acetohydrazide
sc-321383	2-[ (4-Methylbenzyl) thio]acetohydrazide
sc-321348	2-[ (4-Chlorobenzyl) thio]acetohydrazide
ADA15040	2-[ (4-Chlorophenyl) sulfanyl]acetohydrazide
sc-282806	2-[ (4-chlorophenyl) amino]acetohydrazide
sc-321185	2-[ (2,4-Dichlorobenzyl) thio]acetohydrazide
sc-321265	2-[ (3,4-Dichlorobenzyl) thio]acetohydrazide