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1-Decanethiol pure, 95%

CAT: 0565-72007-01Size: 100 mLDry Ice: NoHazardous: No
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CAT#:0565-72007-01Size:100 mL
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Description
Part B
CAS Number
143-10-2
UN Code
UN No.: 3334, IMCO Class No.: 9, Packing Group: III
Storage Temperature
Room Temperature

Chemical Information

1-Decanethiol

1-decanethiol is a colorless liquid with a strong odor.

CAS Number143-10-2
PubChem CID8917
IUPAC Namedecane-1-thiol
Molecular FormulaC10H22S
Molecular Weight174.35
XLogP5.5
Topological Polar Surface Area1
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count1
Rotatable Bond Count8
Heavy Atom Count11
Formal Charge0
Complexity61
SMILES
CCCCCCCCCCS
InChI
InChI=1S/C10H22S/c1-2-3-4-5-6-7-8-9-10-11/h11H,2-10H2,1H3
InChIKey
VTXVGVNLYGSIAR-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of 1-Decanethiol
CAS: 143-10-2
CID: 8917
Formula: C10H22S
MW: 174.35
Interactive 3D Structure
Loading 3D structure...
Computed Properties
PropertyValue
Molecular Weight174.35
XLogP35.5
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count1
Rotatable Bond Count8
Exact Mass174.14422188
Monoisotopic Mass174.14422188
Topological Polar Surface Area1 Ų
Heavy Atom Count11
Formal Charge0
Complexity61.9
Isotope Atom Count0
Defined Atom Stereocenter Count0
Undefined Atom Stereocenter Count0
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
Covalently-Bonded Unit Count1
Compound Is CanonicalizedYes