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Camphorsulfonic Acid
CAS: 5872-08-2 | C10H16O4S
2D Structure
3D Structure
Loading 3D structure...
Basic Information
CAS Registry Number:
5872-08-2
Molecular Formula:
C10H16O4S
Molecular Mass:
232.30 g/mol
Names and Synonyms:
Camphorsulfonic Acid
Bicyclo[2.2.1]heptane-1-methanesulfonic acid, 7,7-dimethyl-2-oxo-
10-Bornanesulfonic acid, 2-oxo-, (±)-
Bicyclo[2.2.1]heptane-1-methanesulfonic acid, 7,7-dimethyl-2-oxo-, (±)-
7,7-Dimethyl-2-oxobicyclo[2.2.1]heptane-1-methanesulfonic acid
(±)-Camphor-10-sulfonic acid
DL-10-Camphorsulfonic acid
(±)-Camphorsulfonic acid
(RS)-10-Camphorsulfonic acid
2-Oxo-10-bornanesulfonic acid
DL-Camphorsulfonic acid
(7,7-Dimethyl-2-oxobicyclo[2.2.1]heptan-1-yl)methanesulfonic acid
(7,7-Dimethyl-3-oxoniumylidene-4-bicyclo[2.2.1]heptanyl)methanesulfonate
(7,7-Dimethyl-2-oxobicyclo[2.2.1]hept-1-yl)methanesulfonic acid
Bicyclo[2.2.1]heptane-1-methanesulfonic acid, 4,7,7-trimethyl-
Identifiers:
SMILES:
CC1(C)C2CCC1(CS(=O)(=O)O)C(=O)C2
InChI:
InChI=1S/C10H16O4S/c1-9(2)7-3-4-10(9,8(11)5-7)6-15(12,13)14/h7H,3-6H2,1-2H3,(H,12,13,14)
Key Properties
Melting Point
153 °C
CAS Common Chemistry
Spectral Data
NMR, IR, and Mass spectral data
1H NMR
13C NMR
Predicting NMR spectra...
10 ppm
9
8
7
6
5
4
3
2
1
0 ppm
| Shift (ppm) | Multiplicity | Integration | Assignment |
|---|
200 ppm
180
160
140
120
100
80
60
40
20
0 ppm
| Shift (ppm) | DEPT | Assignment |
|---|
Note: These NMR spectra are predicted computationally and may differ from experimental data. Predictions are based on chemical environment analysis.
All Properties
Comprehensive physical and chemical properties
| Property | Value | Source |
|---|---|---|
| Molecular Mass | 232.30 g/mol | CAS Common Chemistry |
| 232.301 g/mol | RDKit | |
| 232.076929992 g/mol | RDKit | |
| Wikipedia Url | https://en.wikipedia.org/wiki/Camphorsulfonic_acid | CAS Common Chemistry |
| Canonical SMILES | O=C1CC2CCC1(CS(=O)(=O)O)C2(C)C | CAS Common Chemistry |
| InChI | InChI=1S/C10H16O4S/c1-9(2)7-3-4-10(9,8(11)5-7)6-15(12,13)14/h7H,3-6H2,1-2H3,(H,12,13,14) | CAS Common Chemistry |
| InChI Key | InChIKey=MIOPJNTWMNEORI-UHFFFAOYSA-N | CAS Common Chemistry |
| Melting Point | 153 °C | CAS Common Chemistry |
| Name | (±)-Camphorsulfonic acid | CAS Common Chemistry |
| Camphorsulfonic acid | CAS Common Chemistry | |
| Heavy Atom Count | 15 | RDKit |
| Hydrogen Bond Acceptors | 3 | RDKit |
| Hydrogen Bond Donors | 1 | RDKit |
| Rotatable Bonds | 2 | RDKit |
| Aromatic Ring Count | 0 | RDKit |
| Topological Polar Surface Area | 71.44 Ų | RDKit |
| LogP | 1.2695999999999998 | RDKit |
| Molar Refractivity | 54.97760000000003 | RDKit |
