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Molecule
Ribulose
CAS: 488-84-6 · C5H10O5
2D Structure
3D Structure
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Basic Information
- CAS Registry Number
- 488-84-6
- Molecular Formula
- C5H10O5
- Molecular Mass
- 150.13 g/mol
Identifiers
CAS Registry Number
488-84-6
SMILES
O=C(CO)[C@H](O)[C@H](O)CO
InChI Key
ZAQJHHRNXZUBTE-NQXXGFSBSA-N
InChI
InChI=1S/C5H10O5/c6-1-3(8)5(10)4(9)2-7/h3,5-8,10H,1-2H2/t3-,5-/m1/s1
Names and Synonyms
- Ribulose Synonym
- D-erythro-2-Pentulose Synonym
- D-erythro-Pentulose Synonym
- D-Arabinulose Synonym
- D-Araboketose Synonym
- D-Erythropentulose Synonym
- D-erythro-2-Ketopentose Synonym
- D-Ribulose Synonym
- D-Adonose Synonym
- D(-)-Ribulose Synonym
- D-Ribosone Synonym
All Properties
Comprehensive physical and chemical properties
| Property | Value | Source |
|---|---|---|
| Molecular Mass | 150.13 g/mol | CAS Common Chemistry |
| 150.12999999999997 g/mol | RDKit | |
| Wikipedia Url | https://en.wikipedia.org/wiki/Ribulose | CAS Common Chemistry |
| Canonical SMILES | O=C(CO)C(O)C(O)CO | CAS Common Chemistry |
| InChI | InChI=1S/C5H10O5/c6-1-3(8)5(10)4(9)2-7/h3,5-8,10H,1-2H2/t3-,5-/m1/s1 | CAS Common Chemistry |
| InChI Key | InChIKey=ZAQJHHRNXZUBTE-NQXXGFSBSA-N | CAS Common Chemistry |
| Name | D-Ribulose | CAS Common Chemistry |
| Heavy Atom Count | 10 | RDKit |
| Hydrogen Bond Acceptors | 5 | RDKit |
| Hydrogen Bond Donors | 4 | RDKit |
| Rotatable Bonds | 4 | RDKit |
| Aromatic Ring Count | 0 | RDKit |
| Topological Polar Surface Area | 97.99000000000001 Ų | RDKit |
| 97.99 Ų | RDKit | |
| LogP | -2.7381000000000006 | RDKit |
| -2.7381 | RDKit | |
| Molar Refractivity | 31.19219999999999 cm³/mol | RDKit |
| Ring Count | 0 | RDKit |
| Formal Charge | 0 | RDKit |
| Fraction Csp3 | 0.8 | RDKit |
| Exact Mass | 150.05282342 g/mol | RDKit |
Spectral Data
NMR, IR, and Mass spectral data
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.
External Resources
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MW = 150.13 g/mol. Edit any field — others recompute live.
Related
Related molecules
Other compounds with formula C5H10O5.
