4-Bromomethyl-1,1-difluoro-cyclohexane

C₇H₁₁BrF₂CAS 858121-94-5213.07 g/mol

Open in Covalent MOL file

Properties

Molecular formula: C₇H₁₁BrF₂
Molar mass: 213.07 g/mol
Exact mass: 212.0012 Da
logP: 3.21Crippen estimate
Polar surface area: 0.0 Å²
H-bond donors / acceptors: 0 / 0
Rotatable bonds: 1

Hazards

No GHS classification is on file for this compound. That is not evidence that it is harmless. Search the SDS library

Identifiers

CAS number

858121-94-5

SMILES

C1CC(CCC1CBr)(F)F

InChIKey

VVBAHFKQTKRMAS-UHFFFAOYSA-N

InChI

InChI=1S/C7H11BrF2/c8-5-6-1-3-7(9,10)4-2-6/h6H,1-5H2

Weigh it out

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Names and synonyms

1 names

4-(Bromomethyl)-1,1-difluorocyclohexane

Work with 4-Bromomethyl-1,1-difluoro-cyclohexane

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

(4,4-Difluorocyclohexyl)methanol178312-48-652 % similar (Bromomethyl)cyclopropane7051-34-550 % similar (Bromomethyl)cyclobutane17247-58-445 % similar (Bromomethyl)cyclopentane3814-30-045 % similar 4,4-Difluorocyclohexanol22419-35-844 % similar 4,4-Difluorocyclohexanamine458566-84-244 % similar Cyclohexylmethyl bromide2550-36-943 % similar 4-Bromomethyltetrahydropyran125552-89-840 % similar

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

Same formula

(2E)-1-Bromo-1,1-difluorohept-2-ene262296-38-8

Elsewhere

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