Piperonyl alcohol
Properties
- Molecular formula
- C8H8O3
- Molar mass
- 152.15 g/mol
- Exact mass
- 152.0473 Da
- Melting point
- 58 °C
- Boiling point
- 157 °C
- logP
- 0.91Crippen estimate
- Polar surface area
- 38.7 Ų
- H-bond donors / acceptors
- 1 / 3
- Rotatable bonds
- 1
Identifiers
CAS number
495-76-1SMILES
OCc1ccc2c(c1)OCO2InChIKey
BHUIUXNAPJIDOG-UHFFFAOYSA-NInChI
InChI=1S/C8H8O3/c9-4-6-1-2-7-8(3-6)11-5-10-7/h1-3,9H,4-5H2Weigh it out
Type any one amount. The others follow from the molar mass.
Names and synonyms
15 names · show all
- 1,3-Benzodioxole-5-methanol
- 1-Hydroxymethyl-3,4-methylenedioxybenzene
- 3,4-Methylenedioxybenzyl alcohol
- 5-Hydroxymethyl-1,3-benzodioxole
- Piperonol
- 3,4-(Methylenedioxy)benzenemethanol
- 3,4-Methylenedioxyphenylmethanol
- Benzo[1,3]dioxol-5-ylmethanol
- NSC 26265
- (Benzodioxol-5-yl)methanol
- Benzo[d][1,3]dioxol-5-ylmethanol
- Heliotropyl alcohol
- Benzo[d][1,3]dioxol-5-ylmethyl alcohol
- (1,3-Dioxaindan-5-yl)methanol
- 2H-1,3-Benzodioxol-5-ylmethanol
Work with Piperonyl alcohol
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
Piperonyl chloride20850-43-559 % similar
1,3-Benzodioxole-5-methanamine2620-50-059 % similar
Veratrole alcohol93-03-857 % similar
1,3-Benzodioxole-5-ethanamine1484-85-155 % similar
(2,3-Dihydro-1-benzofuran-5-yl)methanol103262-35-753 % similar
1,3-Benzodioxole-5-acetonitrile4439-02-553 % similar
Safrole94-59-753 % similar
1,3-Benzodioxole-5-acetic acid2861-28-153 % similar
Tanimoto similarity of circular fingerprints over the whole catalogue. All similar compounds