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Home > Amines > 2357-47-3

2357-47-3

2357-47-3 | Benzenamine, 4-fluoro-3-(trifluoromethyl)-

CAS No: 2357-47-3 Catalog No: AG002NP4 MDL No:MFCD00007834

Product Description

Catalog Number:
AG002NP4
Chemical Name:
Benzenamine, 4-fluoro-3-(trifluoromethyl)-
CAS Number:
2357-47-3
Molecular Formula:
C7H5F4N
Molecular Weight:
179.1149
MDL Number:
MFCD00007834
IUPAC Name:
4-fluoro-3-(trifluoromethyl)aniline
InChI:
InChI=1S/C7H5F4N/c8-6-2-1-4(12)3-5(6)7(9,10)11/h1-3H,12H2
InChI Key:
PGFQDLOMDIBAPY-UHFFFAOYSA-N
SMILES:
Nc1ccc(c(c1)C(F)(F)F)F
EC Number:
219-095-7
UNII:
V5584X2CTL
NSC Number:
10326

Properties

Complexity:
156  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
179.036g/mol
Formal Charge:
0
Heavy Atom Count:
12  
Hydrogen Bond Acceptor Count:
5  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
179.118g/mol
Monoisotopic Mass:
179.036g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
26A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.2  

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