Potassium sec-butylxanthogenate

CAT: 0127-OR1038704Size: 10 gDry Ice: NoHazardous: No

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CAT#:0127-OR1038704Size:10 g

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CAS Number

141-96-8

Purity

97%

Smiles

S=C(OC(CC)C)S.[K]

Chemical Information

Potassium sec-butyl xanthate

CAS Number	141-96-8
PubChem CID	23673568
IUPAC Name	potassium butan-2-yloxymethanedithioate
Molecular Formula	C5H9KOS2
Molecular Weight	188.4
Topological Polar Surface Area	42.3
Hydrogen Bond Donor Count	0
Hydrogen Bond Acceptor Count	3
Rotatable Bond Count	3
Heavy Atom Count	9
Formal Charge	0
Complexity	87

SMILES

CCC(C)OC(=S)[S-].[K+]

InChI

InChI=1S/C5H10OS2.K/c1-3-4(2)6-5(7)8;/h4H,3H2,1-2H3,(H,7,8);/q;+1/p-1

InChIKey

UCEWNBKJSLZBOB-UHFFFAOYSA-M

Chemical Structure

2D Structure

CAS: 141-96-8

CID: 23673568

Formula: C5H9KOS2

MW: 188.4

Interactive 3D Structure

Loading 3D structure...

Computed Properties

Property	Value
Molecular Weight	188.4
Hydrogen Bond Donor Count	0
Hydrogen Bond Acceptor Count	3
Rotatable Bond Count	3
Exact Mass	187.97318874
Monoisotopic Mass	187.97318874
Topological Polar Surface Area	42.3 Å²
Heavy Atom Count	9
Formal Charge	0
Complexity	87
Isotope Atom Count	0
Defined Atom Stereocenter Count	0
Undefined Atom Stereocenter Count	1
Defined Bond Stereocenter Count	0
Undefined Bond Stereocenter Count	0
Covalently-Bonded Unit Count	2
Compound Is Canonicalized	Yes

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OR95428-01	2-sec-Butylphenol
OR939965	Sec-butyl butyrate
OR1078808-01	Sec-Butyl Acetate
IN13171-01	Aluminum sec-Butoxide
OR1030630-01	Sec-Butyl Crotonate
OR1044257	Di-sec-butoxyaluminoxytriethoxysilane

Catalog	Name
sc-272102A	Potassium sec-butyltrifluoroborate
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ant-174	IgA Sec
GWB-B79F28	SEC Antibody
582022	sec-Butylamine
O01700-01	Sec-Octylamine
FB142662-01	Sec-Butylbenzene
RG-A261447-01	Sec-Butyllithium
BZ34240	PHL-sec
sc-73353	SEC (C165)