7-Methyl-4-(piperidin-1-ium-1-ylmethyl)-3,4-dihydro-2H-1-benzoxepin-5-one chloride

Catalog Number

ACM96401682

Product Name

7-Methyl-4-(piperidin-1-ium-1-ylmethyl)-3,4-dihydro-2H-1-benzoxepin-5-one chloride

CAS

96401-68-2

Category

Heterocyclic Organic Compound

Synonyms

1-Benzoxepin-5(2H)-one, 3,4-dihydro-7-methyl-4-(piperidinomethyl)-, hydrochloride, 1-Benzoxepin-5(2H)-one, 3,4-dihydro-7-methyl-4-(1-piperidinylmethyl)-, hydrochloride, 3,4-Dihydro-7-methyl-4-(1-piperidinomethyl)-1-benzoxepin-5(2H)-one hydrochloride, AC1L1M8J, LS-42543, 7-methyl-4-(piperidin-1-ium-1-ylmethyl)-3,4-dihydro-2H-1-benzoxepin-5-one chloride, 96401-68-2

IUPAC Name

7-methyl-4-(piperidin-1-ium-1-ylmethyl)-3,4-dihydro-2H-1-benzoxepin-5-one;chloride

Molecular Weight

309.831 g/mol

Molecular Formula

C₁₇H₂₄ClNO₂

Canonical SMILES

CC1=CC2=C(C=C1)OCCC(C2=O)C[NH+]3CCCCC3.[Cl-]

InChI Key

HXVSRHFBERGWGN-UHFFFAOYSA-N

Melting Point

158-159 °C

Exact Mass

309.15000

H-Bond Acceptor

3

H-Bond Donor

1

MSDS

COA

Spec Sheet