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1070892-68-0 | 3-Chloro-5-fluoro-N-methylaniline
CAS No: 1070892-68-0 Catalog No: AG01FEAE MDL No:
Product Description
Catalog Number:
AG01FEAE
Chemical Name:
3-Chloro-5-fluoro-N-methylaniline
CAS Number:
1070892-68-0
Molecular Formula:
C7H7ClFN
Molecular Weight:
159.5886
IUPAC Name:
3-chloro-5-fluoro-N-methylaniline
InChI:
InChI=1S/C7H7ClFN/c1-10-7-3-5(8)2-6(9)4-7/h2-4,10H,1H3
InChI Key:
KIOOGPMCBALVER-UHFFFAOYSA-N
SMILES:
CNc1cc(F)cc(c1)Cl
Properties
Complexity:
110
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:
1
Topological Polar Surface Area:
12A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.6
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