1,3-Oxazol-4-ylmethanol

C₄H₅NO₂CAS 155742-48-699.09 g/mol

Open in Covalent MOL file

Alcohol

Properties

Molecular formula: C₄H₅NO₂
Molar mass: 99.09 g/mol
Exact mass: 99.0320 Da
logP: 0.17Crippen estimate
Polar surface area: 46.3 Å²
H-bond donors / acceptors: 1 / 3
Rotatable bonds: 1

Hazards

Warning

H226 Flammable liquid and vapor66.7% of notifiers
H302 Harmful if swallowed33.3% of notifiers
H315 Causes skin irritation100% of notifiers
H319 Causes serious eye irritation100% of notifiers
H332 Harmful if inhaled33.3% of notifiers
H335 May cause respiratory irritation100% of notifiers

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

Precautionary statements

P210, P233, P240, P241, P242, P243, P261, P264, P264+P265, P270, P271, P280, P301+P317, P302+P352, P303+P361+P353, P304+P340, P305+P351+P338, P317, P319, P321, P330, P332+P317, P337+P317, P362+P364, P370+P378, P403+P233, P403+P235, P405, P501

Identifiers

CAS number

155742-48-6

SMILES

C1=C(N=CO1)CO

InChIKey

BKHIXCNJVHVHAG-UHFFFAOYSA-N

InChI

InChI=1S/C4H5NO2/c6-1-4-2-7-3-5-4/h2-3,6H,1H2

Weigh it out

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

Names and synonyms

1 names

4-Oxazolemethanol

Work with 1,3-Oxazol-4-ylmethanol

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

2-Pyridinemethanol586-98-138 % similar 2-Pyrazinemethanol6705-33-538 % similar 4-Hydroxymethylthiazole7036-04-638 % similar 2,6-Pyridinedimethanol1195-59-137 % similar 4-Methyloxazole693-93-637 % similar (Pyrimidin-4-yl)methanol33581-98-537 % similar (5-Chloropyrazin-2-yl)methanol72788-94-435 % similar 3-Furanmethanol4412-91-334 % similar

Tanimoto similarity of circular fingerprints over the whole catalogue.

All similar compounds

Same formula

3-Hydroxy-5-methylisoxazole10004-44-1 Methyl cyanoacetate105-34-0 Succinimide123-56-8 Methyl isocyanoacetate39687-95-1 Ethyl cyanoformate623-49-4

Elsewhere

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