Home Other Building Blocks 3-(2,2-difluoroethoxy)-4-methylaniline

3-(2,2-difluoroethoxy)-4-methylaniline

CAS No.:
1183987-08-7
Catalog Number:
AG01A9LW
Molecular Formula:
C9H11F2NO
Molecular Weight:
187.1865
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Product Description
Catalog Number:
AG01A9LW
Chemical Name:
3-(2,2-difluoroethoxy)-4-methylaniline
CAS Number:
1183987-08-7
Molecular Formula:
C9H11F2NO
Molecular Weight:
187.1865
IUPAC Name:
3-(2,2-difluoroethoxy)-4-methylaniline
InChI:
InChI=1S/C9H11F2NO/c1-6-2-3-7(12)4-8(6)13-5-9(10)11/h2-4,9H,5,12H2,1H3
InChI Key:
WYTQHCQAWMMFDL-UHFFFAOYSA-N
SMILES:
FC(COc1cc(N)ccc1C)F
Properties
Complexity:
155  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
187.081g/mol
Formal Charge:
0
Heavy Atom Count:
13  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
187.19g/mol
Monoisotopic Mass:
187.081g/mol
Rotatable Bond Count:
3  
Topological Polar Surface Area:
35.2A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.4  
Properties