(1S)-(+)-10-Camphorsulfonamide

C10H17NO3SCAS 60933-63-3231.31 g/mol

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OSOOH2N
KetoneSulfonamide

Properties

Molecular formula
C10H17NO3S
Molar mass
231.31 g/mol
Exact mass
231.0929 Da
logP
0.67Crippen estimate
Polar surface area
77.2 Ų
H-bond donors / acceptors
1 / 3
Rotatable bonds
2
Stereocentres
Sin SMILES atom order

Hazards

No GHS classification is on file for this compound. That is not evidence that it is harmless.

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Identifiers

CAS number
60933-63-3
SMILES
CC1(C2CC[C@]1(C(=O)C2)CS(=O)(=O)N)C
InChIKey
SBLUNABTQYDFJM-OMNKOJBGSA-N
InChI
InChI=1S/C10H17NO3S/c1-9(2)7-3-4-10(9,8(12)5-7)6-15(11,13)14/h7H,3-6H2,1-2H3,(H2,11,13,14)/t7?,10-/m1/s1
Characterization data

Calculated from the structure, in the form journals print them.

¹H NMR
Predicted ¹H NMR (400 MHz, CDCl₃) δ 4.70 (br s, 2H), 3.25 (s, 2H), 2.16 (d, J = 7.0 Hz, 2H), 1.71 (quint, J = 7.0 Hz, 1H), 1.71 (t, J = 7.0 Hz, 2H), 1.51 (q, J = 7.0 Hz, 2H), 0.86 (s, 6H).
¹³C NMR
Predicted ¹³C NMR (101 MHz, CDCl₃) δ 223.6, 71.8, 52.3, 46.8, 45.0, 41.3, 30.3, 28.8, 18.9.
[M + H]+
[M + H]+ Calcd for C10H18NO3S 232.1002
[M + Na]+
[M + Na]+ Calcd for C10H17NNaO3S 254.0821
[M − H]−
[M − H]− Calcd for C10H16NO3S 230.0856
Elemental analysis
Anal. Calcd for C10H17NO3S: C, 51.93; H, 7.41; N, 6.06; S, 13.86.

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Names and synonyms

1 name
  • ((1S)-7,7-Dimethyl-2-oxobicyclo[2.2.1]heptan-1-yl)methanesulfonamide

Work with (1S)-(+)-10-Camphorsulfonamide

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.

(1R)-10-Camphorsulfonamide72597-34-3Stereoisomer

Similar compounds

Camphor-10-sulfonyl chloride21286-54-466 % similar D-Camphorsulfonic acid3144-16-966 % similar (-)-Camphorsulfonic acid35963-20-366 % similar DL-Camphorsulfonic acid5872-08-266 % similar Sodium (+)-10-camphorsulfonate21791-94-661 % similar Sodium DL-10-camphorsulfonate34850-66-361 % similar (±)-Camphor21368-68-348 % similar (-)-Camphor464-48-248 % similar

Tanimoto similarity of circular fingerprints over the whole catalogue.

All similar compounds

Elsewhere

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