chempirical

Cyclamic acid

C6H13NO3SCAS 100-88-9179.23 g/mol

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Properties

Molecular formula
C6H13NO3S
Molar mass
179.23 g/mol
Exact mass
179.0616 Da
Melting point
169.5 °C
logP
0.71Crippen estimate
Polar surface area
66.4 Ų
H-bond donors / acceptors
2 / 2
Rotatable bonds
2

Hazards

Warning
Irritant (GHS07)

Aggregated from 28 ECHA notifications, via PubChem; a share says how many notifiers assign that statement.

Precautionary statements

P264, P264+P265, P280, P302+P352, P305+P351+P338, P321, P332+P317, P337+P317, P362+P364

Identifiers

CAS number
100-88-9
SMILES
O=S(=O)(O)NC1CCCCC1
InChIKey
HCAJEUSONLESMK-UHFFFAOYSA-N
InChI
InChI=1S/C6H13NO3S/c8-11(9,10)7-6-4-2-1-3-5-6/h6-7H,1-5H2,(H,8,9,10)

Weigh it out

Type any one amount. The others follow from the molar mass.

Names and synonyms

11 names
  • Sulfamic acid, N-cyclohexyl-
  • Cyclohexanesulfamic acid
  • Sulfamic acid, cyclohexyl-
  • N-Cyclohexylsulfamic acid
  • Cyclamate
  • Cyclohexylsulfamic acid
  • Hexamic acid
  • Cyclohexylaminesulfonic acid
  • Cyclohexylamidosulfuric acid
  • Polycat 200
  • NSC 220327

Work with Cyclamic acid

Predict the NMR spectrum1H and 13C shifts with multiplicities Make a solutionWhat to weigh for any molarity and volume Check drug-likenessLipinski, Veber and lead-likeness Isotope patternExact mass and the mass spectrum pattern

Stereoisomers, salts and isotopologues

The same compound in another form: other stereochemistry, a salt or hydrate, the free acid or base, or an isotope-labelled version.

Cyclamate139-05-9Salt

Similar compounds

Ches (buffer)103-47-944 % similar Caps (buffer)1135-40-642 % similar CAPSO73463-39-540 % similar N-Cyclohexyl-4-toluenesulfonamide80-30-838 % similar Dicyclohexylamine101-83-738 % similar Cyclohexylurea698-90-837 % similar Dicyclohexylammonium nitrite3129-91-735 % similar N-Cyclohexylthiourea5055-72-135 % similar

Tanimoto similarity of circular fingerprints over the whole catalogue. All similar compounds

Same formula

Fudosteine13189-98-5 4-(2-Hydroxyethyl)thiomorpholine 1,1-dioxide26475-62-7

Elsewhere

PubChem CAS Common Chemistry NIST WebBook Wikipedia