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118276-06-5 | 3,5-Difluoro-4-hydroxybenzaldehyde
CAS No: 118276-06-5 Catalog No: AG003IMH MDL No:MFCD06797917
Product Description
Catalog Number:
AG003IMH
Chemical Name:
3,5-Difluoro-4-hydroxybenzaldehyde
CAS Number:
118276-06-5
Molecular Formula:
C7H4F2O2
Molecular Weight:
158.1023
MDL Number:
MFCD06797917
IUPAC Name:
3,5-difluoro-4-hydroxybenzaldehyde
InChI:
InChI=1S/C7H4F2O2/c8-5-1-4(3-10)2-6(9)7(5)11/h1-3,11H
InChI Key:
SKOYTQILPMNZQO-UHFFFAOYSA-N
SMILES:
O=Cc1cc(F)c(c(c1)F)O
Properties
Complexity:
139
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
158.018g/mol
Formal Charge:
0
Heavy Atom Count:
11
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
158.104g/mol
Monoisotopic Mass:
158.018g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
37.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.2
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