L-Mannose

HCID 82308

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Basic information

CAS: 10030-80-5
Standard SMILES: O=C[C@H](O)[C@H](O)[C@@H](O)[C@@H](O)CO
InChIKey: GZCGUPFRVQAUEE-BXKVDMCESA-N
Molecular formula: C6H12O6
Average molar mass: 180.16 g/mol
Monoisotopic mass: 180.0633881

Names & identifiers

Preferred name: L-Mannose
IUPAC: (2R,3R,4S,5S)-2,3,4,5,6-pentahydroxyhexanal
English name: L-(-)-Mannose
Molecular formula: C6H12O6
Molecular weight: 180.16

Names & synonyms

L-Mannose10030-80-5(2R,3R,4S,5S)-2,3,4,5,6-pentahydroxyhexanalMannose, L-2W3YE50TX8DTXSID20884248CHEBI:37676RefChem:810591GlyTouCan:G69182IIDTXCID801023702G69182II233-080-2

Show more names

laevo-mannoseL-Mannose ,98%L-MANNOPYRANOSEl-[3-13C]MannoseL-(-)-Mannose>l-[UL-13C6]MannoseMANNOSE, L-(-)-(RG)

L-(-)-Mannosealdehydo-L-mannoseMFCD00136021aldehydo-L-manno-hexoseEINECS 233-080-2L- pound - pound(c)-MannoseCHEBI:37681GEO-04666

Database identifiers

CAS: 10030-80-5
PubChem CID: 82308
DTXSID: DTXSID20884248
ChEBI: CHEBI:37681
UNII: 2W3YE50TX8
EC Number: 233-080-2
Nikkaji: J15.570E

Properties

Computed structural properties

XLogP: -2.9
Topological polar surface area: 118 Å²
Hydrogen bond donors: 5
Hydrogen bond acceptors: 6
Rotatable bonds: 5
Heavy atoms: 12
Formal charge: 0
Complexity: 138

Physicochemical properties

Melting point: 129 · 129-131 °C(lit.)
Boiling point: 232.96 °C · 232.96°C (rough estimate)
Density: 1.2805 · 1.2805 (rough estimate)
refractive index: -14 ° · -14 ° (C=4, H2O)
storage temp.: 2 · Inert atmosphere,2-8°C
solubility: 2 O: · H2O: 0.1 g/mL, clear, colorless
pka: 12.45 · 12.45±0.20(Predicted)
form: Powder
color: White to off-white
Water Solubility: Soluble in Water (100 mg/mL).
BRN: 1724628 · 1724628
InChI: 1S/C6H12O6/c7-1-2-3(8)4(9)5(10)6(11)12-2/h2-11H,1H2/t2-,3-,4+,5+,6/m0/s1
InChIKey: WQZGKKKJIJFFOK-JFNONXLTSA-N
SMILES: OC[C@@H]1OC(O)[C@H](O)[C@H](O)[C@H]1O
LogP: -3.29 · -3.290 (est)
CAS DataBase Reference: 10030 · 10030-80-5(CAS DataBase Reference)
FDA UNII: 2 W3YE50TX8 · 2W3YE50TX8
EPA Substance Registry System: L-Mannose (10030-80-5)
UNSPSC Code: 12352201 · 12352201
NACRES: 25 · NA.25
Symbol(GHS): 7 · GHS07
Signal word: Warning
Hazard statements: 302 · H302-H315-H319-H335
Precautionary statements: 261 · P261-P305+P351+P338
PPE: 95 · Eyeshields, Gloves, type N95 (US)
Hazard Codes: Xi
Risk Statements: 36 · 36/37/38
Safety Statements: 22 · 22-24/25-36-26
WGK Germany: 3 · 3
F: 3 · 3-10
TSCA: TSCA listed
HS Code: 29400000 · 29400000
Storage Class: 11 · 11 - Combustible Solids