Name: Name:Benzoic acid, 4-amino-3-fluoro-, 1,1-dimethylethyl ester
Brand: Angene
SKU: AG001PLM
Rating: 90 (10 reviews)

Benzoic acid, 4-amino-3-fluoro-, 1,1-dimethylethyl ester

CAS No.:

157665-53-7

Catalog Number:

AG001PLM

Molecular Formula:

C11H14FNO2

Molecular Weight:

211.2328

Catalog Number:

AG001PLM

Chemical Name:

Benzoic acid, 4-amino-3-fluoro-, 1,1-dimethylethyl ester

CAS Number:

157665-53-7

Molecular Formula:

C11H14FNO2

Molecular Weight:

211.2328

MDL Number:

MFCD08703399

IUPAC Name:

tert-butyl 4-amino-3-fluorobenzoate

InChI:

InChI=1S/C11H14FNO2/c1-11(2,3)15-10(14)7-4-5-9(13)8(12)6-7/h4-6H,13H2,1-3H3

InChI Key:

FYHPHTHRJPRDSU-UHFFFAOYSA-N

SMILES:

O=C(c1ccc(c(c1)F)N)OC(C)(C)C

Complexity:

237

Compound Is Canonicalized:

Yes

Covalently-Bonded Unit Count:

Defined Atom Stereocenter Count:

Defined Bond Stereocenter Count:

Exact Mass:

211.101g/mol

Formal Charge:

Heavy Atom Count:

Hydrogen Bond Acceptor Count:

Hydrogen Bond Donor Count:

Isotope Atom Count:

Molecular Weight:

211.236g/mol

Monoisotopic Mass:

211.101g/mol

Rotatable Bond Count:

Topological Polar Surface Area:

52.3A^2

Undefined Atom Stereocenter Count:

Undefined Bond Stereocenter Count:

XLogP3:

2.3