Pentitol
Basic information
- CAS
2152-56-9- Standard SMILES
OCC(O)C(O)C(O)CO- InChIKey
HEBKCHPVOIAQTA-UHFFFAOYSA-N- Molecular formula
- C5H12O5
- Average molar mass
- 152.15 g/mol
- Monoisotopic mass
- 152.06847348
Overview
See also: Xylitol (annotation moved to); D-Arabitol (annotation moved to); Ribitol (annotation moved to).
Names & identifiers
- Preferred name
- Pentitol
- IUPAC
- pentane-1,2,3,4,5-pentol
- English name
- arabinitol
- Molecular formula
- C5H12O5
- Molecular weight
- 152.15
Names & synonyms
Pentitol6917-36-8GlyTouCan:G72699UVRefChem:1048587CHEBI:25899DTXSID30859149G72699UVpentane-1,2,3,4,5-pentolDL-Xylitolarabitol(d)D(+)-ArabitolArabitol, D-
Show more names
DL-Arabitol >Einecs 218-440-9DL-Arabitolrel-(2R*,4R*)-Pentane-1,2,3,4,5-pentol
16277-71-7NSC16868NSC25288Adonitol;AdoniteC5H12O5Wood sugar alcohola pentitolArabinitol-
Database identifiers
- CAS
2152-56-9、488-81-3、488-82-4、6917-36-8、7643-75-6、87-99-0- PubChem CID
- 827
- DTXSID
DTXSID7042514- Nikkaji
- J1.453.993J
Properties
Computed structural properties
- XLogP
- -2.5
- Topological polar surface area
- 101 Ų
- Hydrogen bond donors
- 5
- Hydrogen bond acceptors
- 5
- Rotatable bonds
- 4
- Heavy atoms
- 10
- Formal charge
- 0
- Complexity
- 76.1
Physicochemical properties
- Melting point
- 103 °C · 103°C
- Boiling point
- 194.6 °C · 194.6°C (rough estimate)
- Density
- 1.1497 · 1.1497 (rough estimate)
- refractive index
- 1.396 · 1.3960 (estimate)
- pka
- 13.24 · 13.24±0.20(Predicted)
- form
- powder to crystal
- color
- White to Almost white
- Water Solubility
- 678.5 g/L · 678.5g/L(25 ºC)
- Merck
- 14 · 14,762
- Henry's Law Constant
- 9.9 · 9.9×109 mol/(m3Pa) at 25℃, Qin et al. (2021)
- FDA UNII
- 5 Y57M9 · YFV05Y57M9
- HS Code
- 2905.49 · 2905.49.4000
Safety & regulation
Safety information is for reference only and does not replace the supplier’s Safety Data Sheet (SDS), applicable regulations, or professional assessment.
Safety data
- hs_code
- 2905.49.4000
Chemistry & industry
Applications
UsesDL-Arabitol is a biochemical reagent that can be used as a biological material or organic compound for life science related research.
Additional notes
DefinitionChEBI: D-arabinitol is the D-enantiomer of arabinitol. It is an enantiomer of a L-arabinitol.
Related reactions
19 records
Compound notes
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