1H-Indol-4-ol

C8H7NOCAS 2380-94-1133.15 g/mol

Open in Covalent MOL file
OHHN
Phenol

Properties

Molecular formula
C8H7NO
Molar mass
133.15 g/mol
Exact mass
133.0528 Da
Melting point
100 °C
Boiling point
100 °C (at 0.01 Torr)
logP
1.87Crippen estimate
Polar surface area
36.0 Ų
H-bond donors / acceptors
2 / 1
Rotatable bonds
0

Hazards

Warning
Irritant (GHS07)

Aggregated from 51 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
2380-94-1
SMILES
Oc1cccc2[nH]ccc12
InChIKey
NLMQHXUGJIAKTH-UHFFFAOYSA-N
InChI
InChI=1S/C8H7NO/c10-8-3-1-2-7-6(8)4-5-9-7/h1-5,9-10H

Weigh it out

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Names and synonyms

3 names
  • Indol-4-ol
  • 4-Hydroxyindole
  • 4-Hydroxy-1H-indole

Work with 1H-Indol-4-ol

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

4-Chloroindole25235-85-254 % similar Indoxyl480-93-354 % similar 4-Bromoindole52488-36-554 % similar 4-Methylindole16096-32-552 % similar 4-Fluoroindole387-43-952 % similar 4-Aminoindole5192-23-452 % similar Indole-4-methanol1074-85-752 % similar Indole-4-boronic acid220465-43-052 % similar

Tanimoto similarity of circular fingerprints over the whole catalogue.

All similar compounds

Same formula

(+)-Mandelonitrile10020-96-9 5-Methylbenzoxazole10531-78-9 4-Hydroxybenzyl cyanide14191-95-8 3-Methoxybenzonitrile1527-89-5 5-Hydroxyindole1953-54-4 7-Hydroxyindole2380-84-9 6-Hydroxyindole2380-86-1 6,7-Dihydro-5H-1-pyridin-5-one28566-14-5

Elsewhere

PubChem CAS Common Chemistry NIST WebBook