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394-50-3 | 3-Fluoro-2-Hydroxybenzaldehyde
CAS No: 394-50-3 Catalog No: AG0033P2 MDL No:MFCD00003319
Product Description
Catalog Number:
AG0033P2
Chemical Name:
3-Fluoro-2-Hydroxybenzaldehyde
CAS Number:
394-50-3
Molecular Formula:
C7H5FO2
Molecular Weight:
140.1118
MDL Number:
MFCD00003319
IUPAC Name:
3-fluoro-2-hydroxybenzaldehyde
InChI:
InChI=1S/C7H5FO2/c8-6-3-1-2-5(4-9)7(6)10/h1-4,10H
InChI Key:
NWDHTEIVMDYWQJ-UHFFFAOYSA-N
SMILES:
O=Cc1cccc(c1O)F
Properties
Complexity:
127
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
140.027g/mol
Formal Charge:
0
Heavy Atom Count:
10
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
140.113g/mol
Monoisotopic Mass:
140.027g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
37.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.7
Literature
| Title | Journal |
|---|---|
| 2-Fluoro-6-[(E)-(pyridin-2-yl)imino-meth-yl]phenol. | Acta crystallographica. Section E, Structure reports online 20111201 |
| 3-Fluoro-salicylaldoxime at 6.5 GPa. | Acta crystallographica. Section E, Structure reports online 20090801 |
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