Home Aminos Benzoic acid, 5-fluoro-2-(methylamino)-, methyl ester

Benzoic acid, 5-fluoro-2-(methylamino)-, methyl ester

CAS No.:
924668-99-5
Catalog Number:
AG00IH5J
Molecular Formula:
C9H10FNO2
Molecular Weight:
183.1796
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Product Description
Catalog Number:
AG00IH5J
Chemical Name:
Benzoic acid, 5-fluoro-2-(methylamino)-, methyl ester
CAS Number:
924668-99-5
Molecular Formula:
C9H10FNO2
Molecular Weight:
183.1796
MDL Number:
MFCD17292015
IUPAC Name:
methyl 5-fluoro-2-(methylamino)benzoate
InChI:
InChI=1S/C9H10FNO2/c1-11-8-4-3-6(10)5-7(8)9(12)13-2/h3-5,11H,1-2H3
InChI Key:
ACDZIHOCIOJCLI-UHFFFAOYSA-N
SMILES:
COC(=O)c1cc(F)ccc1NC
Properties
Complexity:
187  
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:
3  
Topological Polar Surface Area:
38.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.4  
Properties