Dimethyl Carbonotrithioate

CAT: 0127-OR1023395-01Size: 1 mLDry Ice: NoHazardous: No

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CAT#:0127-OR1023395-01Size:1 mL

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CAS Number

2314-48-9

Synonyms

Bis (methylsulfanyl) methanethione

Purity

98%

Smiles

CSC(=S)SC

Chemical Information

Dimethyl trithiocarbonate

CAS Number	2314-48-9
PubChem CID	16840
IUPAC Name	bis(methylsulfanyl)methanethione
Molecular Formula	C3H6S3
Molecular Weight	138.3
XLogP	2.2
Topological Polar Surface Area	82.7
Hydrogen Bond Donor Count	0
Hydrogen Bond Acceptor Count	3
Rotatable Bond Count	2
Heavy Atom Count	6
Formal Charge	0
Complexity	44

SMILES

CSC(=S)SC

InChI

InChI=1S/C3H6S3/c1-5-3(4)6-2/h1-2H3

InChIKey

IQWMXKTYXNMSLC-UHFFFAOYSA-N

Chemical Structure

2D Structure

CAS: 2314-48-9

CID: 16840

Formula: C3H6S3

MW: 138.3

Interactive 3D Structure

Loading 3D structure...

Computed Properties

Property	Value
Molecular Weight	138.3
XLogP3	2.2
Hydrogen Bond Donor Count	0
Hydrogen Bond Acceptor Count	3
Rotatable Bond Count	2
Exact Mass	137.96316371
Monoisotopic Mass	137.96316371
Topological Polar Surface Area	82.7 Å²
Heavy Atom Count	6
Formal Charge	0
Complexity	44
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

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