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771583-81-4 | 4-Chloro-2-(trifluoromethyl)benzylamine
CAS No: 771583-81-4 Catalog No: AG0033Z1 MDL No:MFCD06213291
Product Description
Catalog Number:
AG0033Z1
Chemical Name:
4-Chloro-2-(trifluoromethyl)benzylamine
CAS Number:
771583-81-4
Molecular Formula:
C8H7ClF3N
Molecular Weight:
209.5961
MDL Number:
MFCD06213291
IUPAC Name:
[4-chloro-2-(trifluoromethyl)phenyl]methanamine
InChI:
InChI=1S/C8H7ClF3N/c9-6-2-1-5(4-13)7(3-6)8(10,11)12/h1-3H,4,13H2
InChI Key:
VPKIGWHSTBKRTA-UHFFFAOYSA-N
SMILES:
NCc1ccc(cc1C(F)(F)F)Cl
Properties
Complexity:
171
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
209.022g/mol
Formal Charge:
0
Heavy Atom Count:
13
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
209.596g/mol
Monoisotopic Mass:
209.022g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
26A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.3
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