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6-Heptene-1-sulfonamide

CAT: 0926-VLB01183-01Size: 50 mgDry Ice: NoHazardous: No
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CAT#:0926-VLB01183-01Size:50 mg
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24/48H Stock Items & 2 to 6 Weeks non Stock Items.
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CAS Number
920011-83-2
MDL Number
MFCD27932882
Smiles
C=CCCCCCS (=O) (=O) N
Molecular Formula
C7H15NO2S
Molecular Weight
177.27 g/mol
Controlled
No

Chemical Information

Hept-6-ene-1-sulfonamide
CAS Number920011-83-2
PubChem CID59127683
IUPAC Namehept-6-ene-1-sulfonamide
Molecular FormulaC7H15NO2S
Molecular Weight177.27
XLogP1.3
Topological Polar Surface Area68.5
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count3
Rotatable Bond Count6
Heavy Atom Count11
Formal Charge0
Complexity191
SMILES
C=CCCCCCS(=O)(=O)N
InChI
InChI=1S/C7H15NO2S/c1-2-3-4-5-6-7-11(8,9)10/h2H,1,3-7H2,(H2,8,9,10)
InChIKey
PJPQEMQFDCNBIG-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of Hept-6-ene-1-sulfonamide
CAS: 920011-83-2
CID: 59127683
Formula: C7H15NO2S
MW: 177.27
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight177.27
XLogP31.3
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count3
Rotatable Bond Count6
Exact Mass177.08234989
Monoisotopic Mass177.08234989
Topological Polar Surface Area68.5 Ų
Heavy Atom Count11
Formal Charge0
Complexity191
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

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