Hexanoic acid,6-isothiocyanato-,methyl ester

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Catalog Number

ACM16424876

Product Name

Structure

CAS

16424-87-6

Category

Heterocyclic Organic Compound

Synonyms

MolPort-002-467-120, ZINC03211135, CID2330679, PB-90157936, 16424-87-6

IUPAC Name

methyl 6-isothiocyanatohexanoate

Molecular Weight

187.259

Molecular Formula

C₈H₁₃NO₂S

Canonical SMILES

COC(=O)CCCCCN=C=S

InChI Key

ARBFBXWBDZCPFW-UHFFFAOYSA-N

Boiling Point

262.3ºC at 760mmHg

Flash Point

112.4ºC

Density

1.05g/cm³

Exact Mass

187.06700

H-Bond Acceptor

H-Bond Donor

MSDS

COA

Spec Sheet

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