4-Hexylbenzoic acid methyl ester

Modify Date: 2025-09-04 18:48:17

4-Hexylbenzoic acid methyl ester Structure
4-Hexylbenzoic acid methyl ester structure
Common Name 4-Hexylbenzoic acid methyl ester
CAS Number 38409-63-1 Molecular Weight 220.30700
Density 0.974g/cm3 Boiling Point 308.5ºC at 760 mmHg
Molecular Formula C14H20O2 Melting Point N/A
MSDS N/A Flash Point 130.9ºC

 Names

Name methyl 4-hexylbenzoate
Synonym More Synonyms

 Chemical & Physical Properties

Density 0.974g/cm3
Boiling Point 308.5ºC at 760 mmHg
Molecular Formula C14H20O2
Molecular Weight 220.30700
Flash Point 130.9ºC
Exact Mass 220.14600
PSA 26.30000
LogP 3.59600
Index of Refraction 1.496
InChIKey RTTGTHPEVMEHEK-UHFFFAOYSA-N
SMILES CCCCCCc1ccc(C(=O)OC)cc1

 Safety Information

HS Code 2916399090

 Synthetic Route

~91%

4-Hexylbenzoic acid methyl ester Structure

4-Hexylbenzoic ...

CAS#:38409-63-1

Literature: Furstner, Alois; Leitner, Andreas; Mendez, Maria Patent: US2003/220498 A1, 2003 ; Location in patent: Page/Page column 4-5; 8-9 ;

~81%

4-Hexylbenzoic acid methyl ester Structure

4-Hexylbenzoic ...

CAS#:38409-63-1

Literature: Wolfe, John P.; Singer, Robert A.; Yang, Bryant H.; Buchwald, Stephen L. Journal of the American Chemical Society, 1999 , vol. 121, # 41 p. 9550 - 9561

~82%

4-Hexylbenzoic acid methyl ester Structure

4-Hexylbenzoic ...

CAS#:38409-63-1

Literature: Furstner, Alois; Leitner, Andreas; Mendez, Maria Patent: US2003/220498 A1, 2003 ; Location in patent: Page/Page column 4; 9 ;

~93%

4-Hexylbenzoic acid methyl ester Structure

4-Hexylbenzoic ...

CAS#:38409-63-1

Literature: Furstner, Alois; Leitner, Andreas; Mendez, Maria Patent: US2003/220498 A1, 2003 ; Location in patent: Page/Page column 4; 9-10 ;

~87%

4-Hexylbenzoic acid methyl ester Structure

4-Hexylbenzoic ...

CAS#:38409-63-1

Literature: Schoch, Roland; Desens, Willi; Werner, Thomas; Bauer, Matthias Chemistry - A European Journal, 2013 , vol. 19, # 47 p. 15816 - 15821

~%

4-Hexylbenzoic acid methyl ester Structure

4-Hexylbenzoic ...

CAS#:38409-63-1

Literature: Wolfe, John P.; Singer, Robert A.; Yang, Bryant H.; Buchwald, Stephen L. Journal of the American Chemical Society, 1999 , vol. 121, # 41 p. 9550 - 9561

~38%

4-Hexylbenzoic acid methyl ester Structure

4-Hexylbenzoic ...

CAS#:38409-63-1

Literature: Fuerstner, Alois; Leitner, Andreas Angewandte Chemie - International Edition, 2002 , vol. 41, # 4 p. 609 - 612

~27%

4-Hexylbenzoic acid methyl ester Structure

4-Hexylbenzoic ...

CAS#:38409-63-1

Literature: Fuerstner, Alois; Leitner, Andreas Angewandte Chemie - International Edition, 2002 , vol. 41, # 4 p. 609 - 612

~%

4-Hexylbenzoic acid methyl ester Structure

4-Hexylbenzoic ...

CAS#:38409-63-1

Literature: Rushworth, Philip J.; Hulcoop, David G.; Fox, David J. Journal of Organic Chemistry, 2013 , vol. 78, # 18 p. 9517 - 9521

 Customs

HS Code 2916399090
Summary 2916399090 other aromatic monocarboxylic acids, their anhydrides, halides, peroxides, peroxyacids and their derivatives VAT:17.0% Tax rebate rate:9.0% Supervision conditions:none MFN tariff:6.5% General tariff:30.0%

 Synonyms

Methyl p-hexylbenzoate
4-Methoxycarbonyl-1-hexyl-benzol
Benzoic acid,4-hexyl-,methyl ester
4-hexylbenzoic acid methyl ester
4-hexyl methyl benzoate
methyl-(4-n-hexyl)benzoate
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