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Glycidyl hexanoate

HCID 28579
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Basic information

CAS
17526-74-8
Standard SMILES
CCCCCC(=O)OCC1CO1
InChIKey
LYJNHHFSQGRJFP-UHFFFAOYSA-N
Molecular formula
C9H16O3
Average molar mass
172.22 g/mol
Monoisotopic mass
172.10994437

Names & identifiers

Preferred name
Glycidyl hexanoate
IUPAC
oxiran-2-ylmethyl hexanoate
English name
Hexanoic acid oxiranylmethyl ester
Molecular formula
C9H16O3
Molecular weight
172.22

Names & synonyms

Glycidyl hexanoateoxiran-2-ylmethyl hexanoate17526-74-8Hexanoic acid oxiranylmethyl ester(Oxiran-2-yl)methyl hexanoateGlycidyl ester of hexanoic acidHexanoic acid, oxiranylmethyl estercaproic acid glycidyl esterBRN 1365955HEXANOIC ACID, 2,3-EPOXYPROPYL ESTERHexanoic Acid 2-Oxiranylmethyl Ester; Hexanoic Acid 2,3-Epoxypropyl Ester; Hexanoic Acid Oxiranylmethyl Ester;Hexanoic acid oxiran-2-ylmethyl ester
Show more names
Hexanoic acid (oxiran-2-yl)methyl esterstarbld0003436SCHEMBL2318734DTXSID60938638LYJNHHFSQGRJFP-UHFFFAOYSA-NMFCD01723334Hexanoic acid, 2-oxiranylmethyl esterHY-W704867

Database identifiers

CAS
17526-74-8
PubChem CID
28579
DTXSID
DTXSID60938638
Nikkaji
J49.412G

Properties

Computed structural properties

XLogP
1.7
Topological polar surface area
38.8 Ų
Hydrogen bond donors
0
Hydrogen bond acceptors
3
Rotatable bonds
7
Heavy atoms
12
Formal charge
0
Complexity
145

Physicochemical properties

Boiling point
194.2 °C · 194.2°C (estimate)
Density
1.03 · 1.0300 (rough estimate)
refractive index
1.4249 · 1.4249 (estimate)
storage temp.
Refrigerator
solubility
Chloroform (Sparingly), Ethyl Acetate (Slightly)
form
Oil
color
Colourless
LogP
1.894 · 1.894 (est)
Symbol(GHS)
7 · GHS07,GHS08
Signal word
Warning
Hazard statements
302 · H302+H312+H332-H315-H319-H341-H227
Precautionary statements
501 · P501-P261-P270-P202-P210-P201-P271-P264-P280-P370+P378-P308+P313-P337+P313-P305+P351+P338-P362+P364-P332+P313-P301+P312+P330-P302+P352+P312-P304+P340+P312-P403+P235-P405

Safety & regulation

Safety information is for reference only and does not replace the supplier’s Safety Data Sheet (SDS), applicable regulations, or professional assessment.

Safety data

Signal word
Warning
Symbol(GHS)
GHS07,GHS08
Hazard statements
H302+H312+H332-H315-H319-H341-H227
Precautionary statements
P501-P261-P270-P202-P210-P201-P271-P264-P280-P370+P378-P308+P313-P337+P313-P305+P351+P338-P362+P364-P332+P313-P301+P312+P330-P302+P352+P312-P304+P340+P312-P403+P235-P405

Chemistry & industry

Applications

UsesGlycidyl Hexanoate is used as a plasticizer for polyvinyl butyral resin composition. Glycidyl Hexanoate is also an antioxidant-rust inhibitor used in the preparation of lubricating oils for refrigerators.

Upstream & downstream products

Upstream raw materials

Allyl hexanoate

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