Home Other Building Blocks 3-methoxy-1-[3-(trifluoromethyl)phenyl]propan-1-amine

3-methoxy-1-[3-(trifluoromethyl)phenyl]propan-1-amine

CAS No.:
1247929-39-0
Catalog Number:
AG01AUOK
Molecular Formula:
C11H14F3NO
Molecular Weight:
233.2302
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Product Description
Catalog Number:
AG01AUOK
Chemical Name:
3-methoxy-1-[3-(trifluoromethyl)phenyl]propan-1-amine
CAS Number:
1247929-39-0
Molecular Formula:
C11H14F3NO
Molecular Weight:
233.2302
MDL Number:
MFCD16821992
IUPAC Name:
3-methoxy-1-[3-(trifluoromethyl)phenyl]propan-1-amine
InChI:
InChI=1S/C11H14F3NO/c1-16-6-5-10(15)8-3-2-4-9(7-8)11(12,13)14/h2-4,7,10H,5-6,15H2,1H3
InChI Key:
OOCWVYDNWHLHQJ-UHFFFAOYSA-N
SMILES:
COCCC(c1cccc(c1)C(F)(F)F)N
Properties
Complexity:
208  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
233.103g/mol
Formal Charge:
0
Heavy Atom Count:
16  
Hydrogen Bond Acceptor Count:
5  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
233.234g/mol
Monoisotopic Mass:
233.103g/mol
Rotatable Bond Count:
4  
Topological Polar Surface Area:
35.2A^2
Undefined Atom Stereocenter Count:
1  
Undefined Bond Stereocenter Count:
0
XLogP3:
1.9  
Properties