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Structure

1-Octen-3-yl-butyrate

CAS
16491-54-6
Catalog Number
ACM16491546
Category
Other Products
Molecular Weight
198.31
Molecular Formula
C12H22O2

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Specification

Synonyms
butanoic acid, 1-Octen-3-yl butyrate, 1-Pentylallyl butyrate, 1-Ethenylhexyl butanoate, 1-Octen-3-ol butyrate, 1-Vinylhexyl butyrate, Amylvinylcarbinyl butyrate, FEMA No. 3612, Butanoic acid, 1-ethenylhexyl ester, W361208_ALDRICH, Butyric acid, 1-pentylallyl ester, 1-OCTEN-3-YL-BUTYRATE, EINECS 240-555-8, MolPort-003-960-145, Butanoic acid 1-octen-3-yl ester, CID27892, BRN 1935498, BUTYRIC ACID, 1-VINYLHEXYL ESTER, AI3-33187, LS-3006
IUPAC Name
oct-1-en-3-yl butanoate
Canonical SMILES
CCCCCC(C=C)OC(=O)CCC
InChI Key
LZWFXVJBIZIHCH-UHFFFAOYSA-N
Boiling Point
248.4ºC at 760mmHg
Melting Point
225-229ºC(lit.)
Flash Point
210
Density
0.87g/mLat25ºC(lit.)
EC Number
240-555-8
Exact Mass
198.16200
H-Bond Acceptor
2
H-Bond Donor
0
WGK Germany
2
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