1-Cyclohexene-1-aceticacid,a-cyano-,methyl ester

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Catalog Number

ACM80632537

Product Name

Structure

CAS

80632-53-7

Category

Heterocyclic Organic Compound

Synonyms

MolPort-001-790-611, EINECS 279-519-1, CID4051647, Methyl 2-cyano-2-(1-cyclohexenyl)acetate, Methyl alpha-cyano-1-cyclohexene-1-acetate, 80632-53-7

IUPAC Name

methyl 2-cyano-2-(cyclohexen-1-yl)acetate

Molecular Weight

179.2157

Molecular Formula

C₁₀H₁₃NO₂

Canonical SMILES

COC(=O)C(C#N)C1=CCCCC1

InChI Key

PZHBBPQFEOOLQL-UHFFFAOYSA-N

Boiling Point

280.4ºC at 760mmHg

Flash Point

127.5ºC

Density

1.098g/cm³

EC Number

279-519-1

Exact Mass

179.09500

H-Bond Acceptor

H-Bond Donor

MSDS

COA

Spec Sheet

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