Home Aminos 4-amino-2-fluoro-5-methyl-benzoic acid methyl ester

4-amino-2-fluoro-5-methyl-benzoic acid methyl ester

CAS No.:
1427398-87-5
Catalog Number:
AG01DYR9
Molecular Formula:
C9H10FNO2
Molecular Weight:
183.1796
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
Product Description
Catalog Number:
AG01DYR9
Chemical Name:
4-amino-2-fluoro-5-methyl-benzoic acid methyl ester
CAS Number:
1427398-87-5
Molecular Formula:
C9H10FNO2
Molecular Weight:
183.1796
MDL Number:
MFCD23707433
IUPAC Name:
methyl 4-amino-2-fluoro-5-methylbenzoate
InChI:
InChI=1S/C9H10FNO2/c1-5-3-6(9(12)13-2)7(10)4-8(5)11/h3-4H,11H2,1-2H3
InChI Key:
RPYSATQZZQGSQI-UHFFFAOYSA-N
SMILES:
COC(=O)c1cc(C)c(cc1F)N
Properties
Complexity:
198  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
183.07g/mol
Formal Charge:
0
Heavy Atom Count:
13  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
183.182g/mol
Monoisotopic Mass:
183.07g/mol
Rotatable Bond Count:
2  
Topological Polar Surface Area:
52.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.6  
Properties