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321-28-8 | 1-Fluoro-2-methoxybenzene
CAS No: 321-28-8 Catalog No: AG003HBD MDL No:MFCD00000316
Product Description
Catalog Number:
AG003HBD
Chemical Name:
1-Fluoro-2-methoxybenzene
CAS Number:
321-28-8
Molecular Formula:
C7H7FO
Molecular Weight:
126.1283
MDL Number:
MFCD00000316
IUPAC Name:
1-fluoro-2-methoxybenzene
InChI:
InChI=1S/C7H7FO/c1-9-7-5-3-2-4-6(7)8/h2-5H,1H3
InChI Key:
JIXDOBAQOWOUPA-UHFFFAOYSA-N
SMILES:
COc1ccccc1F
EC Number:
206-284-4
NSC Number:
10339
Properties
Complexity:
85
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
126.048g/mol
Formal Charge:
0
Heavy Atom Count:
9
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
126.13g/mol
Monoisotopic Mass:
126.048g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
9.2A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.1
Literature
| Title | Journal |
|---|---|
| 5-Aryluracils as potent GnRH antagonists-Characterization of atropisomers. | Bioorganic & medicinal chemistry letters 20080601 |
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