Benzoic acid, 4-fluoro-, phenylmethyl ester

Modify Date: 2024-01-14 01:01:06

Benzoic acid, 4-fluoro-, phenylmethyl ester Structure
Benzoic acid, 4-fluoro-, phenylmethyl ester structure
Common Name Benzoic acid, 4-fluoro-, phenylmethyl ester
CAS Number 59986-44-6 Molecular Weight 230.23400
Density N/A Boiling Point N/A
Molecular Formula C14H11FO2 Melting Point N/A
MSDS N/A Flash Point N/A

 Names

Name benzyl 4-fluorobenzoate
Synonym More Synonyms

 Chemical & Physical Properties

Molecular Formula C14H11FO2
Molecular Weight 230.23400
Exact Mass 230.07400
PSA 26.30000
LogP 3.18270
InChIKey CNTWNLQFUTWHID-UHFFFAOYSA-N
SMILES O=C(OCc1ccccc1)c1ccc(F)cc1

 Synthetic Route

~92%

Benzoic acid, 4-fluoro-, phenylmethyl ester Structure

Benzoic acid, 4...

CAS#:59986-44-6

Literature: The Scripps Research Institute Patent: US2006/178527 A1, 2006 ; Location in patent: Page/Page column 10; sheet 8 ;

~84%

Benzoic acid, 4-fluoro-, phenylmethyl ester Structure

Benzoic acid, 4...

CAS#:59986-44-6

Literature: Liu, Hongqiang; Shi, Guangfa; Pan, Shulei; Jiang, Yuyu; Zhang, Yanghui Organic Letters, 2013 , vol. 15, # 16 p. 4098 - 4101

~77%

Benzoic acid, 4-fluoro-, phenylmethyl ester Structure

Benzoic acid, 4...

CAS#:59986-44-6

Literature: Liu, Lianghui; Yun, Lin; Wang, Zikuan; Fu, Xuefeng; Yan, Chun-Hua Tetrahedron Letters, 2013 , vol. 54, # 39 p. 5383 - 5386

~91%

Benzoic acid, 4-fluoro-, phenylmethyl ester Structure

Benzoic acid, 4...

CAS#:59986-44-6

Literature: Finney, Eric E.; Ogawa, Kelli A.; Boydston, Andrew J. Journal of the American Chemical Society, 2012 , vol. 134, # 30 p. 12374 - 12377

~%

Benzoic acid, 4-fluoro-, phenylmethyl ester Structure

Benzoic acid, 4...

CAS#:59986-44-6

Literature: Augeri, David J.; Baumeister, Steven A.; Bruncko, Milan; Dickman, Daniel A.; Ding, Hong; Dinges, Jurgen; Fesik, Stephen W.; Hajduk, Philip J.; Kunzer, Aaron R.; McClellan, William; Nettesheim, David G.; Oost, Thorsten; Petros, Andrew M.; Rosenberg, Saul H.; Shen, Wang; Thomas, Sheela A.; Wang, Xilu; Wendt, Michael D. Patent: US2002/55631 A1, 2002 ; US 20020055631 A1 Title/Abstract Full Text Show Details Augeri, David J.; Baumeister, Steven A.; Bruncko, Milan; Dickman, Daniel A.; Ding, Hong; Dinges, Jurgen; Fesik, Stephen W.; Hajduk, Philip J.; Kunzer, Aaron R.; McClellan, William; Nettesheim, David G.; Oost, Thorsten; Petros, Andrew M.; Rosenberg, Saul H.; Shen, Wang; Thomas, Sheela A.; Wang, Xilu; Wendt, Michael D. Patent: US2002/86887 A1, 2002 ; US 20020086887 A1

~80%

Benzoic acid, 4-fluoro-, phenylmethyl ester Structure

Benzoic acid, 4...

CAS#:59986-44-6

Literature: Spratt, M. P.; Dorn, H. C. Analytical Chemistry, 1984 , vol. 56, # 12 p. 2038 - 2043

 Synonyms

benzyl p-fluorobenzoate
Benzoic acid,4-fluoro-,phenylmethyl ester
benzyl-4-fluorobenzoate
4-Fluorobenzoic acid,benzyl ester
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