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774-98-1

774-98-1 | Benzenamine, N-ethyl-3-(trifluoromethyl)-

CAS No: 774-98-1 Catalog No: AG005HGG MDL No:MFCD11141972

Product Description

Catalog Number:
AG005HGG
Chemical Name:
Benzenamine, N-ethyl-3-(trifluoromethyl)-
CAS Number:
774-98-1
Molecular Formula:
C9H10F3N
Molecular Weight:
189.1776
MDL Number:
MFCD11141972
IUPAC Name:
N-ethyl-3-(trifluoromethyl)aniline
InChI:
InChI=1S/C9H10F3N/c1-2-13-8-5-3-4-7(6-8)9(10,11)12/h3-6,13H,2H2,1H3
InChI Key:
NKVRBCWUWUEDLT-UHFFFAOYSA-N
SMILES:
CCNc1cccc(c1)C(F)(F)F

Properties

Complexity:
155  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
189.077g/mol
Formal Charge:
0
Heavy Atom Count:
13  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
189.181g/mol
Monoisotopic Mass:
189.077g/mol
Rotatable Bond Count:
2  
Topological Polar Surface Area:
12A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.7  

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