3-(4-Bromophenyl)propan-1-ol

C₉H₁₁BrOCAS 25574-11-2215.09 g/mol

Open in Covalent MOL file

Alcohol Aryl halide

Properties

Molecular formula: C₉H₁₁BrO
Molar mass: 215.09 g/mol
Exact mass: 213.9993 Da
logP: 2.37Crippen estimate
Polar surface area: 20.2 Å²
H-bond donors / acceptors: 1 / 1
Rotatable bonds: 3

Identifiers

CAS number

25574-11-2

SMILES

C1=CC(=CC=C1CCCO)Br

InChIKey

WODKXGCVVOOEIJ-UHFFFAOYSA-N

InChI

InChI=1S/C9H11BrO/c10-9-5-3-8(4-6-9)2-1-7-11/h3-6,11H,1-2,7H2

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Names and synonyms

1 names

3-(4-Bromo-phenyl)-propan-1-ol

Work with 3-(4-Bromophenyl)propan-1-ol

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-(4-Bromophenyl)ethanol4654-39-174 % similar 3-(4-Hydroxyphenyl)-1-propanol10210-17-064 % similar Benzenepropanol122-97-458 % similar 4-Bromobenzyl alcohol873-75-656 % similar 1-Bromo-4-butylbenzene41492-05-156 % similar 1-Benzyl-4-bromobenzene2116-36-154 % similar 1-Bromo-4-pentylbenzene51554-95-154 % similar 4-Pyridinepropanol2629-72-352 % similar

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

Same formula

1-Bromo-3-isopropoxybenzene131738-73-3 Benzyl 2-bromoethyl ether1462-37-9 4-Bromo-2,6-dimethylanisole14804-38-7 2-(4-Bromophenyl)propan-2-ol2077-19-2 1-Bromo-4-propoxybenzene39969-56-7 (3-Bromopropoxy)benzene588-63-6 1-Bromo-2-(1-methylethoxy)benzene701-07-5

Elsewhere

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