Lactose, monohydrate

C12H24O12CAS 10039-26-6360.31 g/mol

Open in Covalent MOL file
OOOOHHOHOOHOHOHOHOHH2O
AcetalAlcoholEther

Properties

Molecular formula
C12H24O12
Molar mass
360.31 g/mol
Exact mass
360.1268 Da
logP
-6.22Crippen estimate
Polar surface area
221.0 Ų
H-bond donors / acceptors
8 / 11
Rotatable bonds
4
Stereocentres
R, R, S, R, S, S, R, R, Rin SMILES atom order

Hazards

No GHS classification is on file for this compound. That is not evidence that it is harmless.

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Identifiers

CAS number
10039-26-6
SMILES
C([C@@H]1[C@@H]([C@@H]([C@H]([C@@H](O1)O[C@@H]2[C@H](OC([C@@H]([C@H]2O)O)O)CO)O)O)O)O.O
InChIKey
WSVLPVUVIUVCRA-RJMJUYIDSA-N
InChI
InChI=1S/C12H22O11.H2O/c13-1-3-5(15)6(16)9(19)12(22-3)23-10-4(2-14)21-11(20)8(18)7(10)17;/h3-20H,1-2H2;1H2/t3-,4-,5+,6+,7-,8-,9-,10-,11?,12+;/m1./s1

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Type any one amount. The others follow from the molar mass.

Work with Lactose, monohydrate

Predict the NMR spectrum1H and 13C shifts with multiplicities Make a solutionWhat to weigh for any molarity and volume Check drug-likenessLipinski, Veber and lead-likeness Isotope patternExact mass and the mass spectrum pattern

Stereoisomers, salts and isotopologues

The same compound in another form: other stereochemistry, a salt or hydrate, the free acid or base, or an isotope-labelled version.

β-Lactose5965-66-2Anhydrous, stereoisomer Amylodextrin9005-84-9Anhydrous, stereoisomer α-D-Lactose14641-93-1Anhydrous, stereoisomer Alpha-Lactose monohydrate5989-81-1Stereoisomer

Similar compounds

Dextrin9004-53-991 % similar Cellulase9012-54-891 % similar β-D-Glucan9041-22-991 % similar Glycogen9005-79-277 % similar Beta-cyclodextrin hydrate68168-23-076 % similar α-D-Glucose monohydrate14431-43-773 % similar α-D-Glucose monohydrate5996-10-173 % similar Laminarin9008-22-470 % similar

Tanimoto similarity of circular fingerprints over the whole catalogue.

All similar compounds

Same formula

Maltose monohydrate6363-53-7 D-(+)-Lactose monohydrate64044-51-5

Elsewhere

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