Lactobionic acid

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Catalog Number
ACM96822
Product Name
Lactobionic acid
Structure
Structure
CAS
96-82-2
Category
Main Products
Synonyms
4-O-β-D-Galactopyranosyl-D-gluconic acid
IUPAC Name
(2R,3R,4R,5R)-2,3,5,6-Tetrahydroxy-4-[(2S,3R,4S,5R,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxyhexanoic acid
Molecular Weight
358.3
Molecular Formula
C12H22O12
Canonical SMILES
C(C1C(C(C(C(O1)OC(C(CO)O)C(C(C(=O)O)O)O)O)O)O)O
InChI
InChI=1S/C12H22O12/c13-1-3(15)10(7(18)8(19)11(21)22)24-12-9(20)6(17)5(16)4(2-14)23-12/h3-10,12-20H,1-2H2,(H,21,22)/t3-,4-,5+,6+,7-,8-,9-,10-,12+/m1/s1
InChI Key
JYTUSYBCFIZPBE-AMTLMPIISA-N
Boiling Point
410.75 °C
Melting Point
113-118 °C(lit.)
Flash Point
319.1 °C
Density
1.4662 g/cm³
Appearance
White to off-white powder
Storage
Inert atmosphere, room temperature
Complexity
406
Exact Mass
358.11112613
Isomeric SMILES
C([C@@H]1[C@@H]([C@@H]([C@H]([C@@H](O1)O[C@H]([C@@H](CO)O)[C@@H]([C@H](C(=O)O)O)O)O)O)O)O
Monoisotopic Mass
358.11112613
Physical State
Solid
pKa
3.28±0.35(Predicted)
Refractive Index
26 ° (C=8.8, H₂O)
Topological Polar Surface Area
218 Ų
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