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116759-33-2 | Benzenamine, 4-chloro-2-fluoro-5-methyl-
CAS No: 116759-33-2 Catalog No: AG000D6E MDL No:MFCD09062485
Product Description
Catalog Number:
AG000D6E
Chemical Name:
Benzenamine, 4-chloro-2-fluoro-5-methyl-
CAS Number:
116759-33-2
Molecular Formula:
C7H7ClFN
Molecular Weight:
159.5886
MDL Number:
MFCD09062485
IUPAC Name:
4-chloro-2-fluoro-5-methylaniline
InChI:
InChI=1S/C7H7ClFN/c1-4-2-7(10)6(9)3-5(4)8/h2-3H,10H2,1H3
InChI Key:
KENAMMSVUHVEOL-UHFFFAOYSA-N
SMILES:
Clc1cc(F)c(cc1C)N
Properties
Complexity:
120
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
159.025g/mol
Formal Charge:
0
Heavy Atom Count:
10
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
159.588g/mol
Monoisotopic Mass:
159.025g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
26A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.3
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