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106809-14-7

106809-14-7 | 2,4-Dichloro-5-fluoro-3-nitrobenzoic acid

CAS No: 106809-14-7 Catalog No: AG003FQ8 MDL No:MFCD03427137

Product Description

Catalog Number:
AG003FQ8
Chemical Name:
2,4-Dichloro-5-fluoro-3-nitrobenzoic acid
CAS Number:
106809-14-7
Molecular Formula:
C7H2Cl2FNO4
Molecular Weight:
253.9995
MDL Number:
MFCD03427137
IUPAC Name:
2,4-dichloro-5-fluoro-3-nitrobenzoic acid
InChI:
InChI=1S/C7H2Cl2FNO4/c8-4-2(7(12)13)1-3(10)5(9)6(4)11(14)15/h1H,(H,12,13)
InChI Key:
PCSAPCNEJUEIGU-UHFFFAOYSA-N
SMILES:
[O-][N+](=O)c1c(Cl)c(cc(c1Cl)F)C(=O)O

Properties

Complexity:
285  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
252.934g/mol
Formal Charge:
0
Heavy Atom Count:
15  
Hydrogen Bond Acceptor Count:
5  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
253.994g/mol
Monoisotopic Mass:
252.934g/mol
Rotatable Bond Count:
1  
Topological Polar Surface Area:
83.1A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.6  

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