N-Octyl Thioglycolate

CAT: 0024-sc-476062Size: 25 gDry Ice: NoHazardous: No

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CAT#:0024-sc-476062Size:25 g

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CAS Number

7664-80-4

Chemical Information

Octyl mercaptoacetate

CAS Number	7664-80-4
PubChem CID	76023
IUPAC Name	octyl 2-sulfanylacetate
Molecular Formula	C10H20O2S
Molecular Weight	204.33
XLogP	3.7
Topological Polar Surface Area	27.3
Hydrogen Bond Donor Count	1
Hydrogen Bond Acceptor Count	3
Rotatable Bond Count	9
Heavy Atom Count	13
Formal Charge	0
Complexity	126

SMILES

CCCCCCCCOC(=O)CS

InChI

InChI=1S/C10H20O2S/c1-2-3-4-5-6-7-8-12-10(11)9-13/h13H,2-9H2,1H3

InChIKey

MADOXCFISYCULS-UHFFFAOYSA-N

Chemical Structure

2D Structure

CAS: 7664-80-4

CID: 76023

Formula: C10H20O2S

MW: 204.33

Interactive 3D Structure

Loading 3D structure...

Computed Properties

Property	Value
Molecular Weight	204.33
XLogP3	3.7
Hydrogen Bond Donor Count	1
Hydrogen Bond Acceptor Count	3
Rotatable Bond Count	9
Exact Mass	204.11840105
Monoisotopic Mass	204.11840105
Topological Polar Surface Area	27.3 Å²
Heavy Atom Count	13
Formal Charge	0
Complexity	126
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
O02270-01	Octyl thioglycolate
B30910-01	N-Butyl thioglycolate
TRC-O547830-100MG	n-Octylammonium Thioglycolate
MBS3612021-01	Sodium thioglycolate
RDM-TiGB-01	Thioglycolate Broth
441443-01	Ammonium Thioglycolate
160185	Methyl Thioglycolate
OR1029200-01	Butyl Thioglycolate
S09140	Stearyl thioglycolate
RDM-TiGA-01	Thioglycolate Agar