Benzoic acid,3-(1-piperidinylmethyl)-,hydrochloride,hydrate(2:2:1)

CAS
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CAS
863991-96-2
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Purity
96%
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Catalog Number

ACM863991962

Product Name

Benzoic acid,3-(1-piperidinylmethyl)-,hydrochloride,hydrate(2:2:1)

Structure

CAS

863991-96-2

Category

Heterocyclic Organic Compound

Synonyms

3-(PIPERDIN-1-YLMETHYL)BENZOIC ACID HYDROCHLORIDE HEMIHYDRATE;3-(PIPERIDIN-1-YLMETHYL)BENZOIC ACID HYDROCHLORIDE HEMIHYDRATE;3-(Piperdin-1-ylmethyl)benzoic acid hydrochloride hemihydrate 97%;3-(PIPERDIN-1-YLMETHYL)BENZOIC ACID HYDROCHLORIDE HEMIHYDRATES

IUPAC Name

3-(piperidin-1-ylmethyl)benzoic acid;hydrate;dihydrochloride

Molecular Weight

529.5

Molecular Formula

C₁₃H₁₇NO₂.ClH.1/₂H₂O

Canonical SMILES

C1CCN(CC1)CC2=CC=CC(=C2)C(=O)O.C1CCN(CC1)CC2=CC=CC(=C2)C(=O)O.O.Cl.Cl

InChI Key

HTWIFQGKFFGIFX-UHFFFAOYSA-N

Boiling Point

459.2ºC at 760 mmHg