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1365988-33-5 | 5-Chloro-3-fluoro-2-methylbenzylamine
CAS No: 1365988-33-5 Catalog No: AG01FD2C MDL No:MFCD21602116
Product Description
Catalog Number:
AG01FD2C
Chemical Name:
5-Chloro-3-fluoro-2-methylbenzylamine
CAS Number:
1365988-33-5
Molecular Formula:
C8H9ClFN
Molecular Weight:
173.6152
MDL Number:
MFCD21602116
IUPAC Name:
(5-chloro-3-fluoro-2-methylphenyl)methanamine
InChI:
InChI=1S/C8H9ClFN/c1-5-6(4-11)2-7(9)3-8(5)10/h2-3H,4,11H2,1H3
InChI Key:
YAIIFWZZQLTFLO-UHFFFAOYSA-N
SMILES:
NCc1cc(Cl)cc(c1C)F
Properties
Complexity:
131
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
173.041g/mol
Formal Charge:
0
Heavy Atom Count:
11
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
173.615g/mol
Monoisotopic Mass:
173.041g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
26A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.9
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