cis-3,4-Dihydroxypyrrolid...

C₄H₁₀ClNO₂CAS 186393-21-5139.58 g/mol

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Alcohol Secondary amine

Properties

Molecular formula: C₄H₁₀ClNO₂
Molar mass: 139.58 g/mol
Exact mass: 139.0400 Da
logP: -1.27Crippen estimate
Polar surface area: 52.5 Å²
H-bond donors / acceptors: 3 / 3
Rotatable bonds: 0
Stereocentres: R, Sin SMILES atom order

Identifiers

CAS number

186393-21-5

SMILES

C1[C@H]([C@H](CN1)O)O.Cl

InChIKey

VADWFRGDDJHKNB-HKTIBRIUSA-N

InChI

InChI=1S/C4H9NO2.ClH/c6-3-1-5-2-4(3)7;/h3-7H,1-2H2;1H/t3-,4+;

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Names and synonyms

1 names

(3S,4R)-Pyrrolidine-3,4-diol hydrochloride

Work with cis-3,4-Dihydroxypyrrolid...

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

Similar compounds

3-Hydroxyazetidine hydrochloride18621-18-658 % similar 3-Azabicyclo[3.1.0]hexane, hydrochloride (1:1)73799-64-145 % similar (R)-(-)-3-Pyrrolidinol hydrochloride104706-47-042 % similar (S)-3-Hydroxypyrrolidine hydrochloride122536-94-142 % similar Octahydrocyclopenta[c]pyrrole hydrochloride112626-50-341 % similar 4-Hydroxypiperidine hydrochloride5382-17-239 % similar (R)-3-Hydroxypiperidine hydrocloride198976-43-138 % similar 3-Hydroxypiperidine hydrochloride64051-79-238 % similar

Tanimoto similarity of circular fingerprints over the whole catalogue. All similar compounds

Same formula

Methyl sarcosinate hydrochloride13515-93-0 (±)-Alanine methyl ester hydrochloride13515-97-4 (R)-2-Aminopropionic acid methyl ester hydrochloride14316-06-4 Dimethylglycine hydrochloride2491-06-7 Alanine methyl ester hydrochloride2491-20-5 Methyl 3-aminopropionate hydrochloride3196-73-4 Glycine ethyl ester hydrochloride623-33-6

Elsewhere

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