Home Other Building Blocks 1-(2-fluoro-4,5-dimethoxyphenyl)ethan-1-amine

1-(2-fluoro-4,5-dimethoxyphenyl)ethan-1-amine

CAS No.:
926251-52-7
Catalog Number:
AG01AIDA
Molecular Formula:
C10H14FNO2
Molecular Weight:
199.2221
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Product Description
Catalog Number:
AG01AIDA
Chemical Name:
1-(2-fluoro-4,5-dimethoxyphenyl)ethan-1-amine
CAS Number:
926251-52-7
Molecular Formula:
C10H14FNO2
Molecular Weight:
199.2221
MDL Number:
MFCD09041441
IUPAC Name:
1-(2-fluoro-4,5-dimethoxyphenyl)ethanamine
InChI:
InChI=1S/C10H14FNO2/c1-6(12)7-4-9(13-2)10(14-3)5-8(7)11/h4-6H,12H2,1-3H3
InChI Key:
XXTAHPCJRMPZFE-UHFFFAOYSA-N
SMILES:
COc1cc(C(N)C)c(cc1OC)F
Properties
Complexity:
180  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
199.101g/mol
Formal Charge:
0
Heavy Atom Count:
14  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
199.225g/mol
Monoisotopic Mass:
199.101g/mol
Rotatable Bond Count:
3  
Topological Polar Surface Area:
44.5A^2
Undefined Atom Stereocenter Count:
1  
Undefined Bond Stereocenter Count:
0
XLogP3:
1.2  
Properties