Home Nitros 2-(2-fluoro-3-methoxy-6-nitrophenyl)acetic acid

2-(2-fluoro-3-methoxy-6-nitrophenyl)acetic acid

CAS No.:
1909313-93-4
Catalog Number:
AG01C2RN
Molecular Formula:
C9H8FNO5
Molecular Weight:
229.1619
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Product Description
Catalog Number:
AG01C2RN
Chemical Name:
2-(2-fluoro-3-methoxy-6-nitrophenyl)acetic acid
CAS Number:
1909313-93-4
Molecular Formula:
C9H8FNO5
Molecular Weight:
229.1619
MDL Number:
MFCD29762743
IUPAC Name:
2-(2-fluoro-3-methoxy-6-nitrophenyl)acetic acid
InChI:
InChI=1S/C9H8FNO5/c1-16-7-3-2-6(11(14)15)5(9(7)10)4-8(12)13/h2-3H,4H2,1H3,(H,12,13)
InChI Key:
DJGAMMPZTGWIIZ-UHFFFAOYSA-N
SMILES:
COc1ccc(c(c1F)CC(=O)O)[N+](=O)[O-]
Properties
Complexity:
280  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
229.039g/mol
Formal Charge:
0
Heavy Atom Count:
16  
Hydrogen Bond Acceptor Count:
6  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
229.163g/mol
Monoisotopic Mass:
229.039g/mol
Rotatable Bond Count:
3  
Topological Polar Surface Area:
92.4A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.3  
Properties