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Home > Aldehydes > 1176475-31-2
1176475-31-2 | 4-fluoro-3-(3-hydroxyphenyl)benzaldehyde
CAS No: 1176475-31-2 Catalog No: AG01DSX7 MDL No:MFCD11933384
Product Description
Catalog Number:
AG01DSX7
Chemical Name:
4-fluoro-3-(3-hydroxyphenyl)benzaldehyde
CAS Number:
1176475-31-2
Molecular Formula:
C13H9FO2
Molecular Weight:
216.2078
MDL Number:
MFCD11933384
IUPAC Name:
4-fluoro-3-(3-hydroxyphenyl)benzaldehyde
InChI:
InChI=1S/C13H9FO2/c14-13-5-4-9(8-15)6-12(13)10-2-1-3-11(16)7-10/h1-8,16H
InChI Key:
GHEBXMMCBCQCKW-UHFFFAOYSA-N
SMILES:
O=Cc1ccc(c(c1)c1cccc(c1)O)F
Properties
Complexity:
244
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
216.059g/mol
Formal Charge:
0
Heavy Atom Count:
16
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
216.211g/mol
Monoisotopic Mass:
216.059g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
37.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.1
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