Honokiol

C₁₈H₁₈O₂CAS 35354-74-6266.34 g/mol

Open in Covalent MOL file

Alkene Phenol

Properties

Molecular formula: C₁₈H₁₈O₂
Molar mass: 266.34 g/mol
Exact mass: 266.1307 Da
Melting point: 87.5 °C
logP: 4.22Crippen estimate
Polar surface area: 40.5 Å²
H-bond donors / acceptors: 2 / 2
Rotatable bonds: 5

Hazards

Danger

H302 Harmful if swallowed27.7% of notifiers
H315 Causes skin irritation27.7% of notifiers
H318 Causes serious eye damage47.5% of notifiers
H319 Causes serious eye irritation52.5% of notifiers
H335 May cause respiratory irritation27.7% of notifiers
H411 Toxic to aquatic life with long lasting effects36.6% of notifiers

Aggregated from 101 ECHA notifications, via PubChem; a share says how many notifiers assign that statement.

Precautionary statements

P261, P264, P264+P265, P270, P271, P273, P280, P301+P317, P302+P352, P304+P340, P305+P351+P338, P305+P354+P338, P317, P319, P321, P330, P332+P317, P337+P317, P362+P364, P391, P403+P233, P405, P501

Identifiers

CAS number

35354-74-6

SMILES

C=CCc1ccc(O)c(-c2ccc(O)c(CC=C)c2)c1

InChIKey

FVYXIJYOAGAUQK-UHFFFAOYSA-N

InChI

InChI=1S/C18H18O2/c1-3-5-13-7-9-18(20)16(11-13)14-8-10-17(19)15(12-14)6-4-2/h3-4,7-12,19-20H,1-2,5-6H2

Weigh it out

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

Names and synonyms

7 names

[1,1′-Biphenyl]-2,4′-diol, 3′,5-di-2-propen-1-yl-
[1,1′-Biphenyl]-2,4′-diol, 3′,5-di-2-propenyl-
3′,5-Di-2-propen-1-yl[1,1′-biphenyl]-2,4′-diol
3′,5-Diallyl-2,4′-biphenyldiol
NSC 293100
2-[4-Hydroxy-3-(2-propenyl)phenyl]-4-(2-propenyl)phenol
2-Allyl-4-(5-allyl-2-hydroxyphenyl)phenol

Work with Honokiol

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

Similar compounds

Hydroxychavicol1126-61-060 % similar 2-Allyl-4-chlorophenol13997-73-454 % similar O,O′-Diallylbisphenol A1745-89-750 % similar Eugenol97-53-050 % similar 2-Allylphenol1745-81-949 % similar 3'-Allyl-4'-hydroxyacetophenone1132-05-447 % similar Chavicol501-92-843 % similar Safrole94-59-738 % similar

Tanimoto similarity of circular fingerprints over the whole catalogue.

All similar compounds

Same formula

1,6-Diphenyl-1,6-hexanedione3375-38-0 Magnolol528-43-8 Dienestrol84-17-3

Elsewhere

PubChem CAS Common Chemistry NIST WebBook Wikipedia