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83072-44-0 | Benzaldehyde, 2-ethoxy-4-hydroxy-
CAS No: 83072-44-0 Catalog No: AG005C80 MDL No:
Product Description
Catalog Number:
AG005C80
Chemical Name:
Benzaldehyde, 2-ethoxy-4-hydroxy-
CAS Number:
83072-44-0
Molecular Formula:
C9H10O3
Molecular Weight:
166.1739
IUPAC Name:
2-ethoxy-4-hydroxybenzaldehyde
InChI:
InChI=1S/C9H10O3/c1-2-12-9-5-8(11)4-3-7(9)6-10/h3-6,11H,2H2,1H3
InChI Key:
GQENNFHUCSKOPN-UHFFFAOYSA-N
SMILES:
CCOc1cc(O)ccc1C=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:
1.4
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