chempirical

4-Bromo-2-tert-butylphenol

C10H13BrOCAS 10323-39-4229.12 g/mol

Open in Covalent MOL file
BrHO
Aryl halidePhenol

Properties

Molecular formula
C10H13BrO
Molar mass
229.12 g/mol
Exact mass
228.0150 Da
logP
3.45Crippen estimate
Polar surface area
20.2 Ų
H-bond donors / acceptors
1 / 1
Rotatable bonds
0

Identifiers

CAS number
10323-39-4
SMILES
CC(C)(C)C1=C(C=CC(=C1)Br)O
InChIKey
IKMJSWBFODAWTC-UHFFFAOYSA-N
InChI
InChI=1S/C10H13BrO/c1-10(2,3)8-6-7(11)4-5-9(8)12/h4-6,12H,1-3H3

Weigh it out

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

Work with 4-Bromo-2-tert-butylphenol

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

tert-Butylhydroquinone1948-33-068 % similar 2,4-Di-tert-butylphenol96-76-462 % similar 2-tert-Butyl-4-methylphenol2409-55-460 % similar 4-Bromo-2,6-di-tert-butylphenol1139-52-259 % similar 2,5-Di-tert-butylhydroquinone88-58-458 % similar 4-Bromocatechol17345-77-656 % similar 3-tert-Butyl-4-hydroxyanisole121-00-655 % similar 2-tert-Butyl-4-ethylphenol96-70-855 % similar

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

Same formula

(4-Bromobutoxy)benzene1200-03-9 2-Bromo-4-tert-butylphenol2198-66-5 Benzyl 3-bromopropyl ether54314-84-0

Elsewhere

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