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Cyclamic acid

CAT: 1568-C09833-50mgSize: 50 mgDry Ice: YesHazardous: No
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CAT#:1568-C09833-50mgSize:50 mg
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CAS Number
100-88-9
Synonyms
NSC 220327
Target
Others
Applications
Others
Smiles
C1CCC (CC1) NS (=O) (=O) O
Molecular Formula
C6H13NO3S
Additionnal Information
Cyclamic acid (NSC 220327) in the form of its sodium or calcium salt is one of the most widely used artificial sweeteners.
Storage Conditions
2 years -80 in solvent

Chemical Information

Cyclamate

Cyclohexylsulfamic acid is a member of the class of sulfamic acids that is sulfamic acid carrying an N-cyclohexyl substituent. It has a role as a human xenobiotic metabolite and an environmental contaminant. It is functionally related to a sulfamic acid. It is a conjugate acid of a cyclohexylsulfamate.

CAS Number100-88-9
PubChem CID7533
IUPAC Namecyclohexylsulfamic acid
Molecular FormulaC6H13NO3S
Molecular Weight179.24
XLogP0.6
Topological Polar Surface Area74.8
Hydrogen Bond Donor Count2
Hydrogen Bond Acceptor Count4
Rotatable Bond Count2
Heavy Atom Count11
Formal Charge0
Complexity200
SMILES
C1CCC(CC1)NS(=O)(=O)O
InChI
InChI=1S/C6H13NO3S/c8-11(9,10)7-6-4-2-1-3-5-6/h6-7H,1-5H2,(H,8,9,10)
InChIKey
HCAJEUSONLESMK-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of Cyclamate
CAS: 100-88-9
CID: 7533
Formula: C6H13NO3S
MW: 179.24
Interactive 3D Structure
Loading 3D structure...
Computed Properties
PropertyValue
Molecular Weight179.24
XLogP30.6
Hydrogen Bond Donor Count2
Hydrogen Bond Acceptor Count4
Rotatable Bond Count2
Exact Mass179.06161445
Monoisotopic Mass179.06161445
Topological Polar Surface Area74.8 Ų
Heavy Atom Count11
Formal Charge0
Complexity200
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