L-Mannitol

HCID 136460CAS 643-01-6

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Basic information

Standard SMILES: OC[C@H](O)[C@H](O)[C@@H](O)[C@@H](O)CO
InChIKey: FBPFZTCFMRRESA-BXKVDMCESA-N
Molecular formula: C6H14O6
Average molar mass: 182.17 g/mol
Monoisotopic mass: 182.07903816

Names & identifiers

Preferred name: L-Mannitol
IUPAC: (2S,3S,4S,5S)-hexane-1,2,3,4,5,6-hexol
English name: L-MANNITOL
Molecular formula: C6H14O6
Molecular weight: 182.17

Names & synonyms

L-Mannitol643-01-6(2S,3S,4S,5S)-hexane-1,2,3,4,5,6-hexolCHEBI:38030DTXSID40214523RefChem:151916GlyTouCan:G25240JVDTXCID70137014G25240JV(2S,3S,4S,5S)-Hexane-1,2,3,4,5,6-hexaolMFCD00154039L-mitobronitol

Show more names

(2S,3S,4S,5S)L-Mannitol>laevo-mannitolL-Mannitol ,97%L-manno-HexitolL-MANNITOL 96+%L-Mannitol (9CI)l-[1-13C]MannitolMannitol, L- (8CI)

SCHEMBL25330D-Mannitol, EP, USP gradeorb1690388GEO-04675AKOS016845898EBC-617058AC-13700DA-65030

Database identifiers

CAS: 643-01-6
PubChem CID: 136460
DTXSID: DTXSID40214523
ChEBI: CHEBI:38030
Nikkaji: J13.213F

Properties

Computed structural properties

XLogP: -3.1
Topological polar surface area: 121 Å²
Hydrogen bond donors: 6
Hydrogen bond acceptors: 6
Rotatable bonds: 5
Heavy atoms: 12
Formal charge: 0
Complexity: 105

Physicochemical properties

Melting point: 165 °C · 165 °C
Boiling point: 494.9 · 494.9±0.0 °C(Predicted)
Density: 1.596 · 1.596±0.06 g/cm3(Predicted)
refractive index: -30 ° · -30 ° (C=5, H2O)
storage temp.: Inert atmosphere,Room Temperature
pka: 13.14 · 13.14±0.20(Predicted)
LogP: -3.262 · -3.262 (est)
CAS DataBase Reference: 643 · 643-01-6
Symbol(GHS): 7 · GHS07
Signal word: Warning
Hazard statements: 302 · H302-H315-H319-H335
Precautionary statements: 261 · P261-P264-P270-P271-P280-P301+P312-P302+P352-P304+P340-P305+P351+P338-P330-P332+P313-P337+P313-P362-P403+P233-P405-P501
HS Code: 29400090 · 29400090

Safety & regulation

Safety data

hs_code: 29400090
Signal word: Warning
Symbol(GHS): GHS07
Hazard statements: H302-H315-H319-H335
Precautionary statements: P261-P264-P270-P271-P280-P301+P312-P302+P352-P304+P340-P305+P351+P338-P330-P332+P313-P337+P313-P362-P403+P233-P405-P501

Chemistry & industry

Applications

UsesLabeled L-Mannitol, used in the preparation of L-fructose and D-sorbose. It is also used in the production of D-Psicose (P839620) from allitol using oxidation of the microbe strain Enterobacter Aerogenes IK7.