3-Hydroxy-1-methyl-5-pyridin-3-yl-pyrrolidin-2-one

CAS
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CAS
34834-67-8
Size
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Purity
90%
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Catalog Number

ACM34834678

Product Name

3-Hydroxy-1-methyl-5-pyridin-3-yl-pyrrolidin-2-one

Structure

CAS

34834-67-8

Category

Heterocyclic Organic Compound

Synonyms

Hydroxycotinine

IUPAC Name

(3R,5S)-3-Hydroxy-1-methyl-5-pyridin-3-ylpyrrolidin-2-one

Molecular Weight

192.21

Molecular Formula

C10H12N2O2

Canonical SMILES

CN1C(CC(C1=O)O)C2=CN=CC=C2

InChI

InChI=1S/C10H12N2O2/c1-12-8(5-9(13)10(12)14)7-3-2-4-11-6-7/h2-4,6,8-9,13H,5H2,1H3/t8-,9+/m0/s1

InChI Key

XOKCJXZZNAUIQN-DTWKUNHWSA-N

Boiling Point

416.5±45.0 °C

Melting Point

107-109 °C

Flash Point

9 °C

Density

1.275±0.06 g/cm³

Storage

Hygroscopic, -20 °C freezer, under inert atmosphere

Complexity

232

Exact Mass

192.089877630

Isomeric SMILES

CN1[C@@H](C[C@H](C1=O)O)C2=CN=CC=C2

Monoisotopic Mass

192.089877630

pKa

13.02±0.40(Predicted)

Topological Polar Surface Area

53.4 Å²

MSDS

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COA

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Spec Sheet

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