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Hexane-2-sulfonamide

CAT: 0926-YZB03170-02Size: 0.5 gDry Ice: NoHazardous: No
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CAT#:0926-YZB03170-02Size:0.5 g
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24/48H Stock Items & 2 to 6 Weeks non Stock Items.
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CAS Number
1248031-70-0
MDL Number
MFCD16672076
Smiles
CCCCC (C) S (=O) (=O) N
Molecular Formula
C6H15NO2S
Molecular Weight
165.26 g/mol
Controlled
No

Chemical Information

Hexane-2-sulfonamide
CAS Number1248031-70-0
PubChem CID18783115
IUPAC Namehexane-2-sulfonamide
Molecular FormulaC6H15NO2S
Molecular Weight165.26
XLogP1.2
Topological Polar Surface Area68.5
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count3
Rotatable Bond Count4
Heavy Atom Count10
Formal Charge0
Complexity169
SMILES
CCCCC(C)S(=O)(=O)N
InChI
InChI=1S/C6H15NO2S/c1-3-4-5-6(2)10(7,8)9/h6H,3-5H2,1-2H3,(H2,7,8,9)
InChIKey
VBYBSBGCKDDXBU-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of Hexane-2-sulfonamide
CAS: 1248031-70-0
CID: 18783115
Formula: C6H15NO2S
MW: 165.26
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight165.26
XLogP31.2
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count3
Rotatable Bond Count4
Exact Mass165.08234989
Monoisotopic Mass165.08234989
Topological Polar Surface Area68.5 Ų
Heavy Atom Count10
Formal Charge0
Complexity169
Isotope Atom Count0
Defined Atom Stereocenter Count0
Undefined Atom Stereocenter Count1
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
Covalently-Bonded Unit Count1
Compound Is CanonicalizedYes

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