(Chloromethyl) (4-chlorophenyl) dioxo-lambda~6~-sulfane

CAT: 0024-sc-326655ASize: 5 mgDry Ice: NoHazardous: No

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CAT#:0024-sc-326655ASize:5 mg

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CAS Number

5943-04-4

Chemical Information

p-Chlorophenyl chloromethyl sulfone

CAS Number	5943-04-4
PubChem CID	80045
IUPAC Name	1-chloro-4-(chloromethylsulfonyl)benzene
Molecular Formula	C7H6Cl2O2S
Molecular Weight	225.09
XLogP	1.9
Topological Polar Surface Area	42.5
Hydrogen Bond Donor Count	0
Hydrogen Bond Acceptor Count	2
Rotatable Bond Count	2
Heavy Atom Count	12
Formal Charge	0
Complexity	224

SMILES

C1=CC(=CC=C1S(=O)(=O)CCl)Cl

InChI

InChI=1S/C7H6Cl2O2S/c8-5-12(10,11)7-3-1-6(9)2-4-7/h1-4H,5H2

InChIKey

SAOGOJANGOKVRG-UHFFFAOYSA-N

Chemical Structure

2D Structure

CAS: 5943-04-4

CID: 80045

Formula: C7H6Cl2O2S

MW: 225.09

Interactive 3D Structure

Loading 3D structure...

Computed Properties

Property	Value
Molecular Weight	225.09
XLogP3	1.9
Hydrogen Bond Donor Count	0
Hydrogen Bond Acceptor Count	2
Rotatable Bond Count	2
Exact Mass	223.9465560
Monoisotopic Mass	223.9465560
Topological Polar Surface Area	42.5 Å²
Heavy Atom Count	12
Formal Charge	0
Complexity	224
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
sc-234334	Chloromethyl 4-chlorophenyl sulfide
sc-297658A	1- (Chloromethyl) -2-[ (4-chlorophenyl) sulfanyl]-benzene
sc-297658	1- (Chloromethyl) -2-[ (4-chlorophenyl) sulfanyl]-benzene
sc-299664	5- (Chloromethyl) -3- (4-chlorophenyl) isoxazole
sc-299664A	5- (Chloromethyl) -3- (4-chlorophenyl) isoxazole
sc-325725	6-[ (4-Chlorophenyl) sulfanyl]nicotinaldehyde
sc-325725A	6-[ (4-Chlorophenyl) sulfanyl]nicotinaldehyde
sc-278409	6- (chloromethyl) -N- (4-chlorophenyl) -1,3,5-triazine-2,4-diamine
sc-299607	4,6-Dioxo-6-phenylhexanoic acid
sc-299607A	4,6-Dioxo-6-phenylhexanoic acid

Catalog	Name
QDC09411-01	4- (Chloromethyl) -2- (4-chlorophenyl) -6-methylpyrimidine
429441-01	(4- (Chloromethyl) phenyl) (phenyl) sulfane
YDA19862-01	4- (Chloromethyl) -6-methylpyrimidine
UDA17063-01	4- (Chloromethyl) -6-methoxypyrimidine
AR-D01934-01	4,5-bis (chloromethyl) -1,3-dioxo-2one
OR345718-01	2- (Chloromethyl) -4,6-dimethylpyrimidine
OR4037-01	2- (Chloromethyl) -4,6-dimethoxypyrimidine
PDA96686-01	4- (Chloromethyl) -2,6-dimethylpyrimidine
OR1059018-01	Methyl 6- (chloromethyl) -4-methoxypicolinate
OR1059223-01	Methyl 6- (chloromethyl) -4-methylpicolinate