Butanoic acid,1-methyl-1,4,7-heptanetriyl ester (9CI)

Modify Date: 2025-08-25 18:46:37

Butanoic acid,1-methyl-1,4,7-heptanetriyl ester (9CI) Structure
Butanoic acid,1-methyl-1,4,7-heptanetriyl ester (9CI) structure
Common Name Butanoic acid,1-methyl-1,4,7-heptanetriyl ester (9CI)
CAS Number 5453-21-4 Molecular Weight 372.49600
Density 1.007g/cm3 Boiling Point 442.5ºC at 760mmHg
Molecular Formula C20H36O6 Melting Point N/A
MSDS N/A Flash Point 187.5ºC

 Names

Name 4,7-di(butanoyloxy)octyl butanoate
Synonym More Synonyms

 Chemical & Physical Properties

Density 1.007g/cm3
Boiling Point 442.5ºC at 760mmHg
Molecular Formula C20H36O6
Molecular Weight 372.49600
Flash Point 187.5ºC
Exact Mass 372.25100
PSA 78.90000
LogP 4.33380
Index of Refraction 1.452
InChIKey CBYWYTIHGQZVDT-UHFFFAOYSA-N
SMILES CCCC(=O)OCCCC(CCC(C)OC(=O)CCC)OC(=O)CCC

 Safety Information

HS Code 2915900090

 Synthetic Route

~%

Butanoic acid,1-methyl-1,4,7-heptanetriyl ester (9CI) Structure

Butanoic acid,1...

CAS#:5453-21-4

Literature: Russell et al. Journal of the American Chemical Society, 1953 , vol. 75, p. 726

 Precursor & DownStream

Precursor  2

DownStream  0

 Customs

HS Code 2915900090
Summary 2915900090 other saturated acyclic monocarboxylic acids and their anhydrides, halides, peroxides and peroxyacids; their halogenated, sulphonated, nitrated or nitrosated derivatives VAT:17.0% Tax rebate rate:9.0% Supervision conditions:AB(certificate of inspection for goods inward,certificate of inspection for goods outward) MFN tariff:5.5% General tariff:30.0%

 Synonyms

octane-1,4,7-triyl tributanoate
1,4,7-tris-butyryloxy-octane
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