Home Aminos methyl 4-amino-3-(difluoromethoxy)benzoate

methyl 4-amino-3-(difluoromethoxy)benzoate

CAS No.:
1096816-13-5
Catalog Number:
AG01AHKM
Molecular Formula:
C9H9F2NO3
Molecular Weight:
217.1695
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Product Description
Catalog Number:
AG01AHKM
Chemical Name:
methyl 4-amino-3-(difluoromethoxy)benzoate
CAS Number:
1096816-13-5
Molecular Formula:
C9H9F2NO3
Molecular Weight:
217.1695
MDL Number:
MFCD12168763
IUPAC Name:
methyl 4-amino-3-(difluoromethoxy)benzoate
InChI:
InChI=1S/C9H9F2NO3/c1-14-8(13)5-2-3-6(12)7(4-5)15-9(10)11/h2-4,9H,12H2,1H3
InChI Key:
QHNAKUPIZUEQKK-UHFFFAOYSA-N
SMILES:
COC(=O)c1ccc(c(c1)OC(F)F)N
Properties
Complexity:
225  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
217.055g/mol
Formal Charge:
0
Heavy Atom Count:
15  
Hydrogen Bond Acceptor Count:
6  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
217.172g/mol
Monoisotopic Mass:
217.055g/mol
Rotatable Bond Count:
4  
Topological Polar Surface Area:
61.6A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2  
Properties