2- (Methylthio) acetyl chloride

CAT: 0926-FM175327-01Size: 0.25 gDry Ice: NoHazardous: No

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CAT#:0926-FM175327-01Size:0.25 g

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CAS Number

35928-65-5

MDL Number

MFCD19667997

Smiles

CSCC (=O) Cl

Molecular Formula

C3H5ClOS

Molecular Weight

124.59 g/mol

Shipping Conditions

Cool Pack

Controlled

Chemical Information

2-(Methylsulfanyl)acetyl chloride

CAS Number	35928-65-5
PubChem CID	11126256
IUPAC Name	2-methylsulfanylacetyl chloride
Molecular Formula	C3H5ClOS
Molecular Weight	124.59
XLogP	1.5
Topological Polar Surface Area	42.4
Hydrogen Bond Donor Count	0
Hydrogen Bond Acceptor Count	2
Rotatable Bond Count	2
Heavy Atom Count	6
Formal Charge	0
Complexity	54

SMILES

CSCC(=O)Cl

InChI

InChI=1S/C3H5ClOS/c1-6-2-3(4)5/h2H2,1H3

InChIKey

OWXCYFUNGFTAMS-UHFFFAOYSA-N

Chemical Structure

2D Structure

CAS: 35928-65-5

CID: 11126256

Formula: C3H5ClOS

MW: 124.59

Interactive 3D Structure

Loading 3D structure...

Computed Properties

Property	Value
Molecular Weight	124.59
XLogP3	1.5
Hydrogen Bond Donor Count	0
Hydrogen Bond Acceptor Count	2
Rotatable Bond Count	2
Exact Mass	123.9749636
Monoisotopic Mass	123.9749636
Topological Polar Surface Area	42.4 Å²
Heavy Atom Count	6
Formal Charge	0
Complexity	54.8
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
FN121016-01	(2-Naphthyloxy) acetyl chloride
DBA03363	2- (2-Methoxyphenyl) acetyl chloride
MCA04437-01	2- (4-Cyanophenyl) acetyl chloride
DDA82646-01	2- (tert-Butoxy) acetyl chloride
ZCA42650-01	2- (4-Methanesulfonylphenyl) acetyl chloride
KCA85381	2- (Dimethylamino) acetyl chloride hydrochloride
AAA77474	(2,4-Dichlorophenoxy) acetyl chloride
PDA18679	Acetyl-13C2 chloride
FP02656-01	Phenyl acetyl chloride
NAA91079-01	M-Tolyl-acetyl chloride

Catalog	Name
OR1072051-01	2- (Methylthio) acetyl chloride
TRC-A164496-100G	Acetyl Chloride
sc-254575	4- (Methylthio) benzyl chloride
OR21399-01	2- (Methylthio) nicotinoyl chloride
sc-486095	3- (Methylthio) propionyl Chloride
abx184589-01	4-(Methylthio)benzyl chloride
sc-226423	4- (Methylthio) benzoyl chloride
OR46685-01	2- (Methylthio) benzoyl chloride
162509	Acetyl-d3 Chloride
440853-01	Acetyl-13C2 Chloride