chempirical

2-(2-Hydroxyethoxy)benzaldehyde

C9H10O3CAS 22042-72-4166.18 g/mol

Open in Covalent MOL file
OOHO
AlcoholAldehydeEther

Properties

Molecular formula
C9H10O3
Molar mass
166.18 g/mol
Exact mass
166.0630 Da
Melting point
158–159 °C
logP
0.87Crippen estimate
Polar surface area
46.5 Ų
H-bond donors / acceptors
1 / 3
Rotatable bonds
4

Identifiers

CAS number
22042-72-4
SMILES
O=Cc1ccccc1OCCO
InChIKey
WGHPWLUYIPUQOJ-UHFFFAOYSA-N
InChI
InChI=1S/C9H10O3/c10-5-6-12-9-4-2-1-3-8(9)7-11/h1-4,7,10H,5-6H2

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Names and synonyms

2 names
  • Benzaldehyde, 2-(2-hydroxyethoxy)-
  • Benzaldehyde, o-(2-hydroxyethoxy)-

Work with 2-(2-Hydroxyethoxy)benzaldehyde

Predict the NMR spectrum1H and 13C shifts with multiplicities Make a solutionWhat to weigh for any molarity and volume Check drug-likenessLipinski, Veber and lead-likeness Isotope patternExact mass and the mass spectrum pattern

Same formula

2',4'-Dihydroxy-3'-methylacetophenone10139-84-1 (4-Methoxyphenyl)acetic acid104-01-8 Ethyl salicylate118-61-6 Veratraldehyde120-14-9 Ethylparaben120-47-8 Ethylvanillin121-32-4 Methyl anisate121-98-2 2-Ethoxybenzoic acid134-11-2

Elsewhere

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