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43057-77-8 | 4-Ethoxysalicylaldehyde
CAS No: 43057-77-8 Catalog No: AG003LBK MDL No:MFCD03032734
Product Description
Catalog Number:
AG003LBK
Chemical Name:
4-Ethoxysalicylaldehyde
CAS Number:
43057-77-8
Molecular Formula:
C9H10O3
Molecular Weight:
166.1739
MDL Number:
MFCD03032734
IUPAC Name:
4-ethoxy-2-hydroxybenzaldehyde
InChI:
InChI=1S/C9H10O3/c1-2-12-8-4-3-7(6-10)9(11)5-8/h3-6,11H,2H2,1H3
InChI Key:
YQHAGJMEOJLAJT-UHFFFAOYSA-N
SMILES:
CCOc1ccc(c(c1)O)C=O
Properties
Complexity:
147
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
166.063g/mol
Formal Charge:
0
Heavy Atom Count:
12
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
166.176g/mol
Monoisotopic Mass:
166.063g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
46.5A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.9
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