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79418-73-8 | Benzaldehyde,2-fluoro-3-hydroxy-4-methoxy-
CAS No: 79418-73-8 Catalog No: AG00520H MDL No:MFCD08669884
Product Description
Catalog Number:
AG00520H
Chemical Name:
Benzaldehyde,2-fluoro-3-hydroxy-4-methoxy-
CAS Number:
79418-73-8
Molecular Formula:
C8H7FO3
Molecular Weight:
170.1378
MDL Number:
MFCD08669884
IUPAC Name:
2-fluoro-3-hydroxy-4-methoxybenzaldehyde
InChI:
InChI=1S/C8H7FO3/c1-12-6-3-2-5(4-10)7(9)8(6)11/h2-4,11H,1H3
InChI Key:
GQWGNIURZTZLNL-UHFFFAOYSA-N
SMILES:
COc1ccc(c(c1O)F)C=O
Properties
Complexity:
162
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
170.038g/mol
Formal Charge:
0
Heavy Atom Count:
12
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
170.139g/mol
Monoisotopic Mass:
170.038g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
46.5A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0.9
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