4-(2-Bromoethyl)-tetrahydropyran

C7H13BrOCAS 4677-20-7193.08 g/mol

Open in Covalent MOL file
OBr
Alkyl halideEther

Properties

Molecular formula
C7H13BrO
Molar mass
193.08 g/mol
Exact mass
192.0150 Da
logP
2.20Crippen estimate
Polar surface area
9.2 Ų
H-bond donors / acceptors
0 / 1
Rotatable bonds
2

Hazards

Danger
Corrosive (GHS05)Irritant (GHS07)

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

Precautionary statements

P260, P261, P264, P264+P265, P270, P271, P280, P301+P317, P301+P330+P331, P302+P352, P302+P361+P354, P304+P340, P305+P354+P338, P316, P317, P319, P321, P330, P332+P317, P362+P364, P363, P403+P233, P405, P501

Identifiers

CAS number
4677-20-7
SMILES
C1COCCC1CCBr
InChIKey
WPDAWFCZGSQOPZ-UHFFFAOYSA-N
InChI
InChI=1S/C7H13BrO/c8-4-1-7-2-5-9-6-3-7/h7H,1-6H2

Weigh it out

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Names and synonyms

1 names
  • 4-(2-Bromoethyl)oxane

Work with 4-(2-Bromoethyl)-tetrahydropyran

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-Bromomethyltetrahydropyran125552-89-857 % similar 2-Cyclohexylethyl bromide1647-26-352 % similar 2-(Tetrahydro-pyran-4-yl)-ethanol4677-18-348 % similar 2-(Oxan-4-yl)ethan-1-amine65412-03-548 % similar 2-Bromoethyl ether5414-19-747 % similar 3-(Bromomethyl)tetrahydrofuran165253-29-246 % similar 1,14-Dibromo-3,6,9,12-tetraoxatetradecane57602-02-545 % similar 4-(Iodomethyl)tetrahydro-2H-pyran101691-94-543 % similar

Tanimoto similarity of circular fingerprints over the whole catalogue.

All similar compounds

Elsewhere

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