Home Other Building Blocks 1-N-propyl-4-(trifluoromethyl)benzene-1,2-diamine

1-N-propyl-4-(trifluoromethyl)benzene-1,2-diamine

CAS No.:
164221-21-0
Catalog Number:
AG01AL06
Molecular Formula:
C10H13F3N2
Molecular Weight:
218.2188
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Product Description
Catalog Number:
AG01AL06
Chemical Name:
1-N-propyl-4-(trifluoromethyl)benzene-1,2-diamine
CAS Number:
164221-21-0
Molecular Formula:
C10H13F3N2
Molecular Weight:
218.2188
MDL Number:
MFCD11186897
IUPAC Name:
1-N-propyl-4-(trifluoromethyl)benzene-1,2-diamine
InChI:
InChI=1S/C10H13F3N2/c1-2-5-15-9-4-3-7(6-8(9)14)10(11,12)13/h3-4,6,15H,2,5,14H2,1H3
InChI Key:
JUGANOCITAMOSV-UHFFFAOYSA-N
SMILES:
CCCNc1ccc(cc1N)C(F)(F)F
Properties
Complexity:
194  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
218.103g/mol
Formal Charge:
0
Heavy Atom Count:
15  
Hydrogen Bond Acceptor Count:
5  
Hydrogen Bond Donor Count:
2  
Isotope Atom Count:
0
Molecular Weight:
218.223g/mol
Monoisotopic Mass:
218.103g/mol
Rotatable Bond Count:
3  
Topological Polar Surface Area:
38A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3  
Properties