Chavicol

C9H10OCAS 501-92-8134.18 g/mol

Open in Covalent MOL file
OH
AlkenePhenol

Properties

Molecular formula
C9H10O
Molar mass
134.18 g/mol
Exact mass
134.0732 Da
Density
1.017–1.023 g/mL
Melting point
15.8 °C
Boiling point
238 °C
logP
2.12Crippen estimate
Polar surface area
20.2 Ų
H-bond donors / acceptors
1 / 1
Rotatable bonds
2

Hazards

Warning
Irritant (GHS07)

Aggregated from 3 ECHA notifications, via PubChem; a share says how many notifiers assign that statement.

Precautionary statements

P261, P264, P264+P265, P271, P280, P302+P352, P304+P340, P305+P351+P338, P319, P321, P332+P317, P337+P317, P362+P364, P403+P233, P405, P501

Identifiers

CAS number
501-92-8
SMILES
C=CCc1ccc(O)cc1
InChIKey
RGIBXDHONMXTLI-UHFFFAOYSA-N
InChI
InChI=1S/C9H10O/c1-2-3-8-4-6-9(10)7-5-8/h2,4-7,10H,1,3H2

Weigh it out

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

Names and synonyms

13 names · show all
  • Phenol, 4-(2-propen-1-yl)-
  • Phenol, p-allyl-
  • Phenol, 4-(2-propenyl)-
  • 4-(2-Propen-1-yl)phenol
  • p-Allylphenol
  • γ-(p-Hydroxyphenyl)-α-propylene
  • p-Hydroxyallylbenzene
  • 4-Allylphenol
  • 3-(p-Hydroxyphenyl)-1-propene
  • NSC 290195
  • 4-(2-Propenyl)phenol
  • (4-Hydroxyphenyl)-2-propene
  • 1-Allyl-4-hydroxybenzene

Work with Chavicol

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

Similar compounds

Phenylpropene300-57-256 % similar Hydroxychavicol1126-61-055 % similar Magnolol528-43-855 % similar Estragole140-67-050 % similar Bisphenol F620-92-850 % similar Gastrodigenin623-05-246 % similar 4-Ethylphenol123-07-944 % similar 4-Vinylphenol2628-17-344 % similar

Tanimoto similarity of circular fingerprints over the whole catalogue.

All similar compounds

Same formula

Phenylacetone103-79-7 Hydrocinnamaldehyde104-53-0 Cinnamyl alcohol104-54-1 (4-Vinylphenyl)methanol1074-61-9 2,6-Dimethylbenzaldehyde1123-56-4 P-Methylacetophenone122-00-9 5-Indanol1470-94-6 2,4-Dimethylbenzaldehyde15764-16-6

Elsewhere

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