4-Bromo-4'-propylbiphenyl

C₁₅H₁₅BrCAS 58743-81-0275.19 g/mol

Open in Covalent MOL file

Properties

Molecular formula: C₁₅H₁₅Br
Molar mass: 275.19 g/mol
Exact mass: 274.0357 Da
logP: 5.07Crippen estimate
Polar surface area: 0.0 Å²
H-bond donors / acceptors: 0 / 0
Rotatable bonds: 3

Hazards

Warning

H400 Very toxic to aquatic life95% of notifiers
H410 Very toxic to aquatic life with long lasting effects95% of notifiers

Aggregated from 40 ECHA notifications, via PubChem; a share says how many notifiers assign that statement.

Precautionary statements

P273, P391, P501

Identifiers

CAS number

58743-81-0

SMILES

CCCC1=CC=C(C=C1)C2=CC=C(C=C2)Br

InChIKey

DPERLOMMOVDOHH-UHFFFAOYSA-N

InChI

InChI=1S/C15H15Br/c1-2-3-12-4-6-13(7-5-12)14-8-10-15(16)11-9-14/h4-11H,2-3H2,1H3

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Names and synonyms

1 names

4-Bromo-4'-n-propylbiphenyl

Work with 4-Bromo-4'-propylbiphenyl

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

1-Bromo-4-propylbenzene588-93-286 % similar 4-Bromo-4'-pentylbiphenyl63619-59-074 % similar 4-Bromo-4'-N-heptylbiphenyl58573-93-671 % similar 1-Bromo-4-butylbenzene41492-05-165 % similar 4-Bromo-4'-ethylbiphenyl58743-79-665 % similar 1-Bromo-4-pentylbenzene51554-95-163 % similar 4-(4-N-Propylphenyl)phenol59748-39-963 % similar 4-Propylbiphenyl10289-45-962 % similar

Tanimoto similarity of circular fingerprints over the whole catalogue.

All similar compounds

Same formula

3,3-Diphenylpropyl bromide20017-68-9

Elsewhere

PubChem CAS Common Chemistry NIST WebBook