Home Other Building Blocks 2-(3,3,3-trifluoropropyl)aniline

2-(3,3,3-trifluoropropyl)aniline

CAS No.:
1384429-88-2
Catalog Number:
AG019TW2
Molecular Formula:
C9H10F3N
Molecular Weight:
189.1776
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Product Description
Catalog Number:
AG019TW2
Chemical Name:
2-(3,3,3-trifluoropropyl)aniline
CAS Number:
1384429-88-2
Molecular Formula:
C9H10F3N
Molecular Weight:
189.1776
MDL Number:
MFCD22370011
IUPAC Name:
2-(3,3,3-trifluoropropyl)aniline
InChI:
InChI=1S/C9H10F3N/c10-9(11,12)6-5-7-3-1-2-4-8(7)13/h1-4H,5-6,13H2
InChI Key:
QOJQZQUKDHVIPF-UHFFFAOYSA-N
SMILES:
Nc1ccccc1CCC(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:
26A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.7  
Properties