Home Other Building Blocks 5-(4-(trifluoromethyl)phenoxy)pentan-1-amine

5-(4-(trifluoromethyl)phenoxy)pentan-1-amine

CAS No.:
1274031-83-2
Catalog Number:
AG01DHKB
Molecular Formula:
C12H16F3NO
Molecular Weight:
247.2567
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Product Description
Catalog Number:
AG01DHKB
Chemical Name:
5-(4-(trifluoromethyl)phenoxy)pentan-1-amine
CAS Number:
1274031-83-2
Molecular Formula:
C12H16F3NO
Molecular Weight:
247.2567
MDL Number:
MFCD16195852
IUPAC Name:
5-[4-(trifluoromethyl)phenoxy]pentan-1-amine
InChI:
InChI=1S/C12H16F3NO/c13-12(14,15)10-4-6-11(7-5-10)17-9-3-1-2-8-16/h4-7H,1-3,8-9,16H2
InChI Key:
NNLHWHMKWBDDER-UHFFFAOYSA-N
SMILES:
NCCCCCOc1ccc(cc1)C(F)(F)F
Properties
Complexity:
200  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
247.118g/mol
Formal Charge:
0
Heavy Atom Count:
17  
Hydrogen Bond Acceptor Count:
5  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
247.261g/mol
Monoisotopic Mass:
247.118g/mol
Rotatable Bond Count:
6  
Topological Polar Surface Area:
35.2A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.9  
Properties