CAS 441067-49-8|CAS 142347-81-7|L-hydroxyproline hydrochloride|(2S,4S)-4-Hydroxypyrrolidine-2-carboxylic acid hydrochloride|(2S,4S)-4-hydroxypyrrolidine-2-carboxylic acid hydrochloride|D-Hydroxyprol...

General Information

Structure

Molecular Formula

C₅H₁₀ClNO₃

Molecular Mass

167.5908

Exact Mass

167.03492087

Charge

InChI

InChI=1S/C5H9NO3.ClH/c7-3-1-4(5(8)9)6-2-3;/h3-4,6-7H,1-2H2,(H,8,9);1H/t3-,4-;/m0./s1

InChIKey

YEJFFQAGTXBSTI-MMALYQPHSA-N

Canonic Smiles

O[C@@H]1CN[C@@H](C1)C(=O)O.Cl

Isomeric Smiles

[C@@H]1(C[C@H](NC1)C(=O)O)O.Cl

Calculated Properties

JChem

Acid pKa

1.641382

H Acceptors

H Donor

LogD (pH = 5.5)

-3.7163465

LogD (pH = 7.4)

-3.7165344

Log P

-3.7163188

Molar Refractivity

29.3822

Polarizability

11.9828205

Polar Surface Area

69.56

Rotatable Bonds

Lipinski's Rule of Five

true

Data Source

Commercial Catalog

Academic Data

Data Source

Names and Identifiers

IUPAC Traditional name

L-hydroxyproline hydrochloride

Synonyms

(2S,4S)-4-Hydroxypyrrolidine-2-carboxylic acid hydrochlorideD-Hydroxyproline Hydrochloridetrans-4-Hydroxy-D-proline HydrochlorideD-trans-4-Hydroxyproline HydrochlorideNSC 206273 Hydrochloride(2R,4S)-(+)-4-Hydroxy-D-proline Hydrochloride4-(S)-Hydroxypyrrolidine-2-(R)-carboxylic Acid Hydrochloride(4S)-4-Hydroxy-D-proline Hydrochloridetrans-4-Hydroxy-D-proline Hydrochloride

IUPAC name

(2S,4S)-4-hydroxypyrrolidine-2-carboxylic acid hydrochloride

Names and Identifiers

Registration numbers

PubChem CID

23395895

PubChem SID

162057407

CAS Number

441067-49-8142347-81-7

MDL Number

MFCD09953187