2-(Tetrahydro-pyran-4-yl)-ethanol

C₇H₁₄O₂CAS 4677-18-3130.19 g/mol

Open in Covalent MOL file

Alcohol Ether

Properties

Molecular formula: C₇H₁₄O₂
Molar mass: 130.19 g/mol
Exact mass: 130.0994 Da
logP: 0.80Crippen estimate
Polar surface area: 29.5 Å²
H-bond donors / acceptors: 1 / 2
Rotatable bonds: 2

Hazards

Warning

H226 Flammable liquid and vapor66.7% of notifiers
H302 Harmful if swallowed66.7% of notifiers
H312 Harmful in contact with skin66.7% 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

4677-18-3

SMILES

C1COCCC1CCO

InChIKey

XZXZZACRGBBWTQ-UHFFFAOYSA-N

InChI

InChI=1S/C7H14O2/c8-4-1-7-2-5-9-6-3-7/h7-8H,1-6H2

Weigh it out

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

Names and synonyms

1 names

2-(Oxan-4-yl)ethan-1-ol

Work with 2-(Tetrahydro-pyran-4-yl)-ethanol

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-Cyclopropylethanol2566-44-161 % similar (Tetrahydro-2H-pyran-4-yl)methanol14774-37-957 % similar Cyclopentaneethanol766-00-755 % similar Cyclohexylethanol4442-79-952 % similar 4-(2-Bromoethyl)-tetrahydropyran4677-20-748 % similar 4-Piperidineethanol622-26-448 % similar 2-(Oxan-4-yl)ethan-1-amine65412-03-548 % similar Diethylene glycol111-46-647 % similar

Tanimoto similarity of circular fingerprints over the whole catalogue.

All similar compounds

Same formula

Propyl butyrate105-66-8 Methyl hexanoate106-70-7 4-Methoxy-4-methyl-2-pentanone107-70-0 Ethyl isovalerate108-64-5 Enanthic acid111-14-8 2,2-Dimethylpentanoic acid1185-39-3 Isoamyl acetate123-92-2 tert-Butyl propionate20487-40-5

Elsewhere

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