Home Other Building Blocks 2-methoxy-1-[3-(trifluoromethyl)phenyl]ethan-1-amine

2-methoxy-1-[3-(trifluoromethyl)phenyl]ethan-1-amine

CAS No.:
953724-21-5
Catalog Number:
AG01AJB9
Molecular Formula:
C10H12F3NO
Molecular Weight:
219.2036
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Product Description
Catalog Number:
AG01AJB9
Chemical Name:
2-methoxy-1-[3-(trifluoromethyl)phenyl]ethan-1-amine
CAS Number:
953724-21-5
Molecular Formula:
C10H12F3NO
Molecular Weight:
219.2036
MDL Number:
MFCD09730685
IUPAC Name:
2-methoxy-1-[3-(trifluoromethyl)phenyl]ethanamine
InChI:
InChI=1S/C10H12F3NO/c1-15-6-9(14)7-3-2-4-8(5-7)10(11,12)13/h2-5,9H,6,14H2,1H3
InChI Key:
BJJLLHRPTHUESQ-UHFFFAOYSA-N
SMILES:
COCC(c1cccc(c1)C(F)(F)F)N
Properties
Complexity:
196  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
219.087g/mol
Formal Charge:
0
Heavy Atom Count:
15  
Hydrogen Bond Acceptor Count:
5  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
219.207g/mol
Monoisotopic Mass:
219.087g/mol
Rotatable Bond Count:
3  
Topological Polar Surface Area:
35.2A^2
Undefined Atom Stereocenter Count:
1  
Undefined Bond Stereocenter Count:
0
XLogP3:
1.6  
Properties