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Norcamphor
CAS: 497-38-1 | C7H10O
2D Structure
3D Structure
Loading 3D structure...
Basic Information
CAS Registry Number:
497-38-1
Molecular Formula:
C7H10O
Molecular Weight:
110.156 g/mol
Names and Synonyms:
Norcamphor
NSC 92359
NSC 66537
Racemic norcamphor
(±)-Norcamphor
dl-Norcamphor
(±)-2-Norbornanone
2,5-Methanocyclohexanone
2-Oxonorbornane
Norcamphor
2-Norbornanone
Bicyclo[2.2.1]heptan-2-one
Identifiers:
SMILES:
O=C1CC2CCC1C2
InChI:
InChI=1S/C7H10O/c8-7-4-5-1-2-6(7)3-5/h5-6H,1-4H2
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
Physical Properties
| Property | Value | Source |
|---|---|---|
| molecular_mass | 110.16 g/mol | Legacy Database |
| wikipedia_url | https://en.wikipedia.org/wiki/Norcamphor None | Legacy Database |
| cas-boiling-point | 68-72 °C @ Press: 12 Torr None | Legacy Database |
| cas-canonical-smile | O=C1CC2CCC1C2 None | Legacy Database |
| cas-inchi | InChI=1S/C7H10O/c8-7-4-5-1-2-6(7)3-5/h5-6H,1-4H2 None | Legacy Database |
| cas-inchi-key | InChIKey=KPMKEVXVVHNIEY-UHFFFAOYSA-N None | Legacy Database |
| cas-melting-point | 93-94 °C None | Legacy Database |
| cas-name | Bicyclo[2.2.1]heptan-2-one None | Legacy Database |
| wikipedia-name | Norcamphor None | Legacy Database |
| LogP | 1.3755 | RDKit |
Molecular
| Property | Value | Source |
|---|---|---|
| Molecular Weight | 110.156 g/mol | RDKit |
Exact
| Property | Value | Source |
|---|---|---|
| Exact Molecular Weight | 110.07316494 g/mol | RDKit |
Heavy
| Property | Value | Source |
|---|---|---|
| Heavy Atom Count | 8 count | RDKit |
Hydrogen
| Property | Value | Source |
|---|---|---|
| Hydrogen Bond Acceptors | 1 count | RDKit |
| Hydrogen Bond Donors | 0 count | RDKit |
Rotatable
| Property | Value | Source |
|---|---|---|
| Rotatable Bonds | 0 count | RDKit |
Aromatic
| Property | Value | Source |
|---|---|---|
| Aromatic Ring Count | 0 count | RDKit |
Topological
| Property | Value | Source |
|---|---|---|
| Topological Polar Surface Area | 17.07 Ų | RDKit |
Molar
| Property | Value | Source |
|---|---|---|
| Molar Refractivity | 30.454999999999984 | RDKit |
