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Home > Aldehydes > 757995-98-5
757995-98-5 | Benzaldehyde,4-ethoxy-2,3-dihydroxy-
CAS No: 757995-98-5 Catalog No: AG005UIF MDL No:MFCD09835409
Product Description
Catalog Number:
AG005UIF
Chemical Name:
Benzaldehyde,4-ethoxy-2,3-dihydroxy-
CAS Number:
757995-98-5
Molecular Formula:
C9H10O4
Molecular Weight:
182.1733
MDL Number:
MFCD09835409
IUPAC Name:
4-ethoxy-2,3-dihydroxybenzaldehyde
InChI:
InChI=1S/C9H10O4/c1-2-13-7-4-3-6(5-10)8(11)9(7)12/h3-5,11-12H,2H2,1H3
InChI Key:
WOSWBATZOUYEOH-UHFFFAOYSA-N
SMILES:
CCOc1ccc(c(c1O)O)C=O
Properties
Complexity:
171
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
182.058g/mol
Formal Charge:
0
Heavy Atom Count:
13
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
182.175g/mol
Monoisotopic Mass:
182.058g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
66.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.4
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