Methyl 2-amino-4,6-difluorobenzoate

Modify Date: 2025-09-24 10:38:04

Methyl 2-amino-4,6-difluorobenzoate Structure
Methyl 2-amino-4,6-difluorobenzoate structure
Common Name Methyl 2-amino-4,6-difluorobenzoate
CAS Number 379228-57-6 Molecular Weight 187.14300
Density 1.355±0.06 g/cm3 Boiling Point 266.1±40.0 ºC (760 Torr)
Molecular Formula C8H7F2NO2 Melting Point N/A
MSDS N/A Flash Point 114.7±27.3 ºC

 Names

Name Methyl 2-amino-4,6-difluorobenzoate
Synonym More Synonyms

 Chemical & Physical Properties

Density 1.355±0.06 g/cm3
Boiling Point 266.1±40.0 ºC (760 Torr)
Molecular Formula C8H7F2NO2
Molecular Weight 187.14300
Flash Point 114.7±27.3 ºC
Exact Mass 187.04400
PSA 52.32000
LogP 1.91480
InChIKey SECMISFZCMBTKJ-UHFFFAOYSA-N
SMILES COC(=O)c1c(N)cc(F)cc1F
Water Solubility Very slightly soluble (0.15 g/L) (25 ºC)

 Synthetic Route

~86%

Methyl 2-amino-4,6-difluorobenzoate Structure

Methyl 2-amino-...

CAS#:379228-57-6

Literature: Hennequin, Laurent F.; Allen, Jack; Breed, Jason; Curwen, Jon; Fennell, Michael; Green, Tim P.; Lambert-Van Der Brempt, Christine; Morgentin, Remy; Norman, Richard A.; Olivier, Annie; Otterbein, Ludovic; Ple, Patrick A.; Warin, Nicolas; Costello, Gerard Journal of Medicinal Chemistry, 2006 , vol. 49, # 22 p. 6465 - 6488

~66%

Methyl 2-amino-4,6-difluorobenzoate Structure

Methyl 2-amino-...

CAS#:379228-57-6

Literature: Ford, J. Gair; Pointon, Simon M.; Powell, Lyn; Siedlecki, Paul S.; Baum, John; Chubb, Richard; Fieldhouse, Robin; Muxworthy, James; Nivlet, Alex; Stenson, Rachel; Warwick, Eleanor Organic Process Research and Development, 2010 , vol. 14, # 5 p. 1078 - 1087

~%

Methyl 2-amino-4,6-difluorobenzoate Structure

Methyl 2-amino-...

CAS#:379228-57-6

Literature: Hennequin, Laurent F.; Allen, Jack; Breed, Jason; Curwen, Jon; Fennell, Michael; Green, Tim P.; Lambert-Van Der Brempt, Christine; Morgentin, Remy; Norman, Richard A.; Olivier, Annie; Otterbein, Ludovic; Ple, Patrick A.; Warin, Nicolas; Costello, Gerard Journal of Medicinal Chemistry, 2006 , vol. 49, # 22 p. 6465 - 6488

~%

Methyl 2-amino-4,6-difluorobenzoate Structure

Methyl 2-amino-...

CAS#:379228-57-6

Literature: Ford, J. Gair; Pointon, Simon M.; Powell, Lyn; Siedlecki, Paul S.; Baum, John; Chubb, Richard; Fieldhouse, Robin; Muxworthy, James; Nivlet, Alex; Stenson, Rachel; Warwick, Eleanor Organic Process Research and Development, 2010 , vol. 14, # 5 p. 1078 - 1087

 Synonyms

Benzoic acid,2-amino-4,6-difluoro-,methyl ester
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