chempirical

Ethylvanillin

C9H10O3CAS 121-32-4166.18 g/mol

Open in Covalent MOL file
OOHO
AlcoholAldehyde

Properties

Molecular formula
C9H10O3
Molar mass
166.18 g/mol
Exact mass
166.0630 Da
Melting point
77.5 °C
Boiling point
285 °C
logP
1.60Crippen estimate
Polar surface area
46.5 Ų
H-bond donors / acceptors
1 / 3
Rotatable bonds
3

Identifiers

CAS number
121-32-4
SMILES
CCOc1cc(C=O)ccc1O
InChIKey
CBOQJANXLMLOSS-UHFFFAOYSA-N
InChI
InChI=1S/C9H10O3/c1-2-12-9-5-7(6-10)3-4-8(9)11/h3-6,11H,2H2,1H3

Weigh it out

Type any one amount. The others follow from the molar mass.

Names and synonyms

18 names · show all
  • Benzaldehyde, 3-ethoxy-4-hydroxy-
  • 3-Ethoxy-4-hydroxybenzaldehyde
  • Bourbonal
  • Ethavan
  • Ethovan
  • Ethylprotal
  • Protocatechuic aldehyde ethyl ether
  • Quantrovanil
  • Vanillal
  • 4-Hydroxy-3-ethoxybenzaldehyde
  • Vanirom
  • 2-Ethoxy-4-formylphenol
  • Rhodiarome
  • NSC 1803
  • NSC 67240
  • Arovanillon
  • 3-Ethylvanillin
  • YS 065

Work with Ethylvanillin

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 Boiling point under vacuumAt any pressure, from its normal boiling point Isotope patternExact mass and the mass spectrum pattern

Same formula

(4-Methoxyphenyl)acetic acid104-01-8 Ethyl salicylate118-61-6 Veratraldehyde120-14-9 Ethylparaben120-47-8 Methyl anisate121-98-2 2-Ethoxybenzoic acid134-11-2 Methyl (4-hydroxyphenyl)acetate14199-15-6 2-(3-Methylphenoxy)acetic acid1643-15-8

Elsewhere

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