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Home > Fluorides > 773873-26-0
773873-26-0 | 2,3-Difluoro-6-methoxybenzoic acid
CAS No: 773873-26-0 Catalog No: AG003FID MDL No:MFCD04116018
Product Description
Catalog Number:
AG003FID
Chemical Name:
2,3-Difluoro-6-methoxybenzoic acid
CAS Number:
773873-26-0
Molecular Formula:
C8H6F2O3
Molecular Weight:
188.1282
MDL Number:
MFCD04116018
IUPAC Name:
2,3-difluoro-6-methoxybenzoic acid
InChI:
InChI=1S/C8H6F2O3/c1-13-5-3-2-4(9)7(10)6(5)8(11)12/h2-3H,1H3,(H,11,12)
InChI Key:
MMTKYWQMCSZCGW-UHFFFAOYSA-N
SMILES:
COc1ccc(c(c1C(=O)O)F)F
Properties
Complexity:
198
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
188.029g/mol
Formal Charge:
0
Heavy Atom Count:
13
Hydrogen Bond Acceptor Count:
5
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
188.13g/mol
Monoisotopic Mass:
188.029g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
46.5A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.6
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