chempirical

4-Chromanol

C9H10O2CAS 1481-93-2150.18 g/mol

Open in Covalent MOL file
OHO
AlcoholEther

Properties

Molecular formula
C9H10O2
Molar mass
150.18 g/mol
Exact mass
150.0681 Da
Melting point
41–42 °C
logP
1.50Crippen estimate
Polar surface area
29.5 Ų
H-bond donors / acceptors
1 / 2
Rotatable bonds
0

Identifiers

CAS number
1481-93-2
SMILES
OC1CCOc2ccccc21
InChIKey
MGSHXMOLUWTMGP-UHFFFAOYSA-N
InChI
InChI=1S/C9H10O2/c10-8-5-6-11-9-4-2-1-3-7(8)9/h1-4,8,10H,5-6H2

Weigh it out

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

Names and synonyms

5 names
  • 2H-1-Benzopyran-4-ol, 3,4-dihydro-
  • 3,4-Dihydro-2H-1-benzopyran-4-ol
  • 4-Hydroxychroman
  • 4-Hydroxy-3,4-dihydro-2H-1-benzopyran
  • 3,4-Dihydro-2H-chromen-4-ol

Work with 4-Chromanol

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

(R)-Chroman-4-amine210488-55-456 % similar (N)Chroman-4-amine hydrochloride1035093-81-251 % similar 1-Indanol6351-10-648 % similar Benzodioxan493-09-444 % similar 1-Tetralol529-33-944 % similar Benzo-18-crown-614098-24-940 % similar Benzo-15-crown-514098-44-340 % similar Dibenzo-24-crown-814174-09-540 % similar

Tanimoto similarity of circular fingerprints over the whole catalogue. All similar compounds

Same formula

Acetanisole100-06-1 4-Ethoxybenzaldehyde10031-82-0 Methyl phenylacetate101-41-7 (2,3-Dihydro-1-benzofuran-5-yl)methanol103262-35-7 2-Phenylethyl formate104-62-1 Hydroxychavicol1126-61-0 3-Methylphenyl acetate122-46-3 Phenyl glycidyl ether122-60-1

Elsewhere

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