2-Deoxypentitol
Completing data — refresh the page later to see the latest
Basic information
- CAS
13942-76-2- Standard SMILES
OCCC(O)C(O)CO- InChIKey
ZDAWZDFBPUUDAY-UHFFFAOYSA-N- Molecular formula
- C5H12O4
- Average molar mass
- 136.15 g/mol
- Monoisotopic mass
- 136.07355886
Names & identifiers
- Preferred name
- 2-Deoxypentitol
- IUPAC
- pentane-1,2,3,5-tetrol
- English name
- D-erythro-Pentitol,2-deoxy-
- Molecular formula
- C5H12O4
- Molecular weight
- 136.15
Names & synonyms
2-deoxypentitolDTXSID30930467RefChem:935463DTXCID5013591942-deoxy-xyluloseNSC67660SCHEMBL346604SCHEMBL6432653SCHEMBL6432863SCHEMBL6432993SCHEMBL6433785SCHEMBL6435099
Show more names
D-erythro-Pentitol,2-deoxy-
SCHEMBL7800121CHEBI:166493NSC-67660
Database identifiers
- CAS
13942-76-2- PubChem CID
- 249377
- DTXSID
DTXSID30930467- ChEBI
CHEBI:166493- Nikkaji
- J2.362.544J
Properties
Computed structural propertiesFilling in
- XLogP
- -2
- Topological polar surface area
- 80.9 Ų
- Hydrogen bond donors
- 4
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 4
- Heavy atoms
- 9
- Formal charge
- 0
- Complexity
- 66
Physicochemical properties
- Boiling point
- 405.3 · 405.3±40.0 °C(Predicted)
- Density
- 1.336 · 1.336±0.06 g/cm3(Predicted)
- pka
- 13.67 · 13.67±0.20(Predicted)
Chemistry & industry
Pharmacology
Cellular LocationsCytoplasm；Extracellular
Additional notes
DefinitionChEBI: 2-Deoxy-D-ribitol is a secondary alcohol.
Suppliers
Loading…
Open inquiries
Loading…
Related reactions
3 records
Compound notes
Loading…