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Home > Fluorides > 1378794-80-9
1378794-80-9 | Benzenemethanol, 5-fluoro-2,3-dimethoxy-
CAS No: 1378794-80-9 Catalog No: AG001400 MDL No:MFCD19439899
Product Description
Catalog Number:
AG001400
Chemical Name:
Benzenemethanol, 5-fluoro-2,3-dimethoxy-
CAS Number:
1378794-80-9
Molecular Formula:
C9H11FO3
Molecular Weight:
186.1802
MDL Number:
MFCD19439899
IUPAC Name:
(5-fluoro-2,3-dimethoxyphenyl)methanol
InChI:
InChI=1S/C9H11FO3/c1-12-8-4-7(10)3-6(5-11)9(8)13-2/h3-4,11H,5H2,1-2H3
InChI Key:
VKQSDTPEPFXCTH-UHFFFAOYSA-N
SMILES:
COc1c(OC)cc(cc1CO)F
Properties
Complexity:
154
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
186.069g/mol
Formal Charge:
0
Heavy Atom Count:
13
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
186.182g/mol
Monoisotopic Mass:
186.069g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
38.7A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.1
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