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958863-59-7

958863-59-7 | N-[2,5-Bis(trifluoromethyl)benzyl]-N-methylamine

CAS No: 958863-59-7 Catalog No: AG01F9OV MDL No:

Product Description

Catalog Number:
AG01F9OV
Chemical Name:
N-[2,5-Bis(trifluoromethyl)benzyl]-N-methylamine
CAS Number:
958863-59-7
Molecular Formula:
C10H9F6N
Molecular Weight:
257.1756
IUPAC Name:
1-[2,5-bis(trifluoromethyl)phenyl]-N-methylmethanamine
InChI:
InChI=1S/C10H9F6N/c1-17-5-6-4-7(9(11,12)13)2-3-8(6)10(14,15)16/h2-4,17H,5H2,1H3
InChI Key:
IYCAWEUONQFGKB-UHFFFAOYSA-N
SMILES:
CNCc1cc(ccc1C(F)(F)F)C(F)(F)F

Properties

Complexity:
246  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
257.064g/mol
Formal Charge:
0
Heavy Atom Count:
17  
Hydrogen Bond Acceptor Count:
7  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
257.179g/mol
Monoisotopic Mass:
257.064g/mol
Rotatable Bond Count:
2  
Topological Polar Surface Area:
12A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.1  

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