Methyl 5-chloro-2-cyanobenzoate

Modify Date: 2025-08-25 18:07:04

Methyl 5-chloro-2-cyanobenzoate Structure
Methyl 5-chloro-2-cyanobenzoate structure
Common Name Methyl 5-chloro-2-cyanobenzoate
CAS Number 439117-38-1 Molecular Weight 195.602
Density 1.3±0.1 g/cm3 Boiling Point 328.1±27.0 °C at 760 mmHg
Molecular Formula C9H6ClNO2 Melting Point N/A
MSDS N/A Flash Point 152.2±23.7 °C

 Names

Name Methyl 5-chloro-2-cyanobenzoate
Synonym More Synonyms

 Chemical & Physical Properties

Density 1.3±0.1 g/cm3
Boiling Point 328.1±27.0 °C at 760 mmHg
Molecular Formula C9H6ClNO2
Molecular Weight 195.602
Flash Point 152.2±23.7 °C
Exact Mass 195.008713
PSA 50.09000
LogP 2.00
Vapour Pressure 0.0±0.7 mmHg at 25°C
Index of Refraction 1.555

 Safety Information

Hazard Codes Xi
HS Code 2926909090

 Synthetic Route

~88%

Methyl 5-chloro-2-cyanobenzoate Structure

Methyl 5-chloro...

CAS#:439117-38-1

Literature: Merck and Co., Inc. Patent: US6528503 B2, 2003 ;

~%

Methyl 5-chloro-2-cyanobenzoate Structure

Methyl 5-chloro...

CAS#:439117-38-1

Literature: MERCK SHARP and DOHME CORP.; XU, Libo; CHOBANIAN, Harry; CAMPBELL, Brian, T.; GUO, Yan; PIO, Barbara; ZHANG, Rui Patent: WO2014/25658 A1, 2014 ; Location in patent: Page/Page column 25 ;

~10%

Methyl 5-chloro-2-cyanobenzoate Structure

Methyl 5-chloro...

CAS#:439117-38-1

Literature: Frantz, Doug E.; Weaver, Damian G.; Carey, James P.; Kress, Michael H.; Dolling, Ulf H. Organic Letters, 2002 , vol. 4, # 26 p. 4717 - 4718

~%

Methyl 5-chloro-2-cyanobenzoate Structure

Methyl 5-chloro...

CAS#:439117-38-1

Literature: Frantz, Doug E.; Weaver, Damian G.; Carey, James P.; Kress, Michael H.; Dolling, Ulf H. Organic Letters, 2002 , vol. 4, # 26 p. 4717 - 4718

~%

Methyl 5-chloro-2-cyanobenzoate Structure

Methyl 5-chloro...

CAS#:439117-38-1

Literature: Morrissette, Matthew M.; Stauffer, Kenneth J.; Williams, Peter D.; Lyle, Terry A.; Vacca, Joseph P.; Krueger, Julie A.; Lewis, S. Dale; Lucas, Bobby J.; Wong, Bradley K.; White, Rebecca B.; Miller-Stein, Cynthia; Lyle, Elizabeth A.; Wallace, Audrey A.; Leonard, Yvonne M.; Welsh, Denise C.; Lynch, Joseph J.; McMasters, Daniel R. Bioorganic and Medicinal Chemistry Letters, 2004 , vol. 14, # 16 p. 4161 - 4164

~%

Methyl 5-chloro-2-cyanobenzoate Structure

Methyl 5-chloro...

CAS#:439117-38-1

Literature: MERCK SHARP and DOHME CORP.; XU, Libo; CHOBANIAN, Harry; CAMPBELL, Brian, T.; GUO, Yan; PIO, Barbara; ZHANG, Rui Patent: WO2014/25658 A1, 2014 ;

 Customs

HS Code 2926909090
Summary HS:2926909090 other nitrile-function compounds VAT:17.0% Tax rebate rate:9.0% Supervision conditions:none MFN tariff:6.5% General tariff:30.0%

 Synonyms

Benzoic acid, 5-chloro-2-cyano-, methyl ester
Methyl5-chloro-2-cyanobenzoate
Methyl 5-chloro-2-cyanobenzoatato
Methyl 5-chloro-2-cyanobenzoate
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