CAS 1069-31-4|CAS 16682-12-5|2,5-diaminopentanoic acid hydrochloride|ornithine L- monohydrochloride hydrochloride|2,5-Diaminopentanoic acid hydrochloride|(±)-2,5-Diaminopentanoic acid monohydrochlo...

General Information

Structure

Molecular Formula

C₅H₁₃ClN₂O₂

Molecular Mass

168.62192

Exact Mass

168.06655535

Charge

InChI

InChI=1S/C5H12N2O2.ClH/c6-3-1-2-4(7)5(8)9;/h4H,1-3,6-7H2,(H,8,9);1H

InChIKey

GGTYBZJRPHEQDG-UHFFFAOYSA-N

Canonic Smiles

NC(C(=O)O)CCCN.Cl

Isomeric Smiles

C(=O)(C(N)CCCN)O.Cl

Calculated Properties

JChem

Acid pKa

2.6664226

H Acceptors

H Donor

LogD (pH = 5.5)

-6.399376

LogD (pH = 7.4)

-5.4160175

Log P

-3.6582875

Molar Refractivity

33.2085

Polarizability

13.533871

Polar Surface Area

89.34

Rotatable Bonds

Lipinski's Rule of Five

true

Data Source

Names and Identifiers

IUPAC name

2,5-diaminopentanoic acid hydrochloride

IUPAC Traditional name

ornithine L- monohydrochloride hydrochloride Orn hydrochloride

Synonyms

2,5-Diaminopentanoic acid hydrochloride(±)-2,5-Diaminopentanoic acid monohydrochloride(±)-2,5-二氨基戊酸单盐酸盐DL-鸟氨酸单盐酸盐DL-Ornithine monohydrochloride(+/-)-2,5-Diaminopentanoic acid hydrochlorideH-DL-Orn-OH.HClDL-鸟氨酸单盐酸盐DL-ORNITHINE HClDL-ORNITHINE MONOHYDROCHLORIDEDL-2,5-Diaminopentanoic acid monohydrochlorideDL-Ornithine hydrochloride

Names and Identifiers

Registration numbers

CAS Number

1069-31-416682-12-5

EC Number

213-956-0

PubChem SID

2488683316099795324897958

MDL Number

MFCD00065398

Beilstein Number

4153338