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Structure

2-Mercaptoethyl 3,5,5-trimethylhexanoate

CAS
67859-58-9
Catalog Number
ACM67859589
Category
Other Products
Molecular Weight
218.356180 [g/mol]
Molecular Formula
C11H22O2S

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Specification

Synonyms
EINECS 267-405-4, CID106913, 2-Mercaptoethyl 3,5,5-trimethylhexanoate, Hexanoic acid, 3,5,5-trimethyl-, 2-mercaptoethyl ester, 67859-58-9
IUPAC Name
2-sulfanylethyl 3,5,5-trimethylhexanoate
Canonical SMILES
CC(CC(=O)OCCS)CC(C)(C)C
InChI Key
HCIZFLGIBDLOLH-UHFFFAOYSA-N
Boiling Point
274.5ºC at 760 mmHg
Flash Point
133.4ºC
Density
0.957g/cm³
EC Number
267-405-4
Exact Mass
218.13400
H-Bond Acceptor
2
H-Bond Donor
0
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