Home Other Building Blocks 1-[4-(difluoromethoxy)-3-methoxyphenyl]ethan-1-amine

1-[4-(difluoromethoxy)-3-methoxyphenyl]ethan-1-amine

CAS No.:
954263-76-4
Catalog Number:
AG019MZR
Molecular Formula:
C10H13F2NO2
Molecular Weight:
217.2125
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Product Description
Catalog Number:
AG019MZR
Chemical Name:
1-[4-(difluoromethoxy)-3-methoxyphenyl]ethan-1-amine
CAS Number:
954263-76-4
Molecular Formula:
C10H13F2NO2
Molecular Weight:
217.2125
MDL Number:
MFCD09736887
IUPAC Name:
1-[4-(difluoromethoxy)-3-methoxyphenyl]ethanamine
InChI:
InChI=1S/C10H13F2NO2/c1-6(13)7-3-4-8(15-10(11)12)9(5-7)14-2/h3-6,10H,13H2,1-2H3
InChI Key:
BEAWGBQBYFZGAN-UHFFFAOYSA-N
SMILES:
COc1cc(ccc1OC(F)F)C(N)C
Properties
Complexity:
192  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
217.091g/mol
Formal Charge:
0
Heavy Atom Count:
15  
Hydrogen Bond Acceptor Count:
5  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
217.216g/mol
Monoisotopic Mass:
217.091g/mol
Rotatable Bond Count:
4  
Topological Polar Surface Area:
44.5A^2
Undefined Atom Stereocenter Count:
1  
Undefined Bond Stereocenter Count:
0
XLogP3:
1.7  
Properties