Methylthiomethyl Acetate

CAT: 0024-sc-470175Size: 25 gDry Ice: NoHazardous: No

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CAT#:0024-sc-470175Size:25 g

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CAS Number

16437-69-7

Chemical Information

Methylthiomethyl Acetate

CAS Number	16437-69-7
PubChem CID	167540
IUPAC Name	methylsulfanylmethyl acetate
Molecular Formula	C4H8O2S
Molecular Weight	120.17
XLogP	0.9
Topological Polar Surface Area	51.6
Hydrogen Bond Donor Count	0
Hydrogen Bond Acceptor Count	3
Rotatable Bond Count	3
Heavy Atom Count	7
Formal Charge	0
Complexity	62

SMILES

CC(=O)OCSC

InChI

InChI=1S/C4H8O2S/c1-4(5)6-3-7-2/h3H2,1-2H3

InChIKey

LCUMNXCSNFGGGH-UHFFFAOYSA-N

Chemical Structure

2D Structure

CAS: 16437-69-7

CID: 167540

Formula: C4H8O2S

MW: 120.17

Interactive 3D Structure

Loading 3D structure...

Computed Properties

Property	Value
Molecular Weight	120.17
XLogP3	0.9
Hydrogen Bond Donor Count	0
Hydrogen Bond Acceptor Count	3
Rotatable Bond Count	3
Exact Mass	120.02450067
Monoisotopic Mass	120.02450067
Topological Polar Surface Area	51.6 Å²
Heavy Atom Count	7
Formal Charge	0
Complexity	62.7
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-269603	(Methylthiomethyl) triphenylphosphonium chloride
sc-268608	Bis (methylthiomethyl) sulfide
sc-269603A	(Methylthiomethyl) triphenylphosphonium chloride
sc-235874	Methylthiomethyl phenyl sulfone
sc-295480A	Methylthiomethyl p-Tolyl Sulfone
sc-295480	Methylthiomethyl p-Tolyl Sulfone
sc-498899	5β-Dihydrocortisone acetate 21-acetate
sc-251068	Strontium acetate
sc-234787	Diphenylmethanethiol acetate
sc-233791	α, α-Dicyanoethyl acetate

Catalog	Name
OR1029628-01	Methylthiomethyl Acetate
OR10723-01	Diethyl (methylthiomethyl) phosphonate
HHC05774-01	Catalponol methylthiomethyl ether
OR1079601-01	Methylthiomethyl Phenyl Sulfone
283336-01	Methylthiomethyl p-tolyl sulfone
TSW-00889-01	3'-O-Methylthiomethyl-dTTP sodium
HY-158716	3'-O-Methylthiomethyl-dTTP (sodium)
GTR19246765-01	3'-O-Methylthiomethyl-dATP sodium
TSW-00891-01	3'-O-Methylthiomethyl-dGTP sodium
HY-158718	3'-O-Methylthiomethyl-dGTP (sodium)