1,4-Dibromo-2,5-bis(bromomethyl)benzene

C₈H₆Br₄CAS 35335-16-1421.75 g/mol

Open in Covalent MOL file

Alkyl halide Aryl halide

Properties

Molecular formula: C₈H₆Br₄
Molar mass: 421.75 g/mol
Exact mass: 417.7203 Da
logP: 5.00Crippen estimate
Polar surface area: 0.0 Å²
H-bond donors / acceptors: 0 / 0
Rotatable bonds: 2

Hazards

Danger

H290 May be corrosive to metals100% of notifiers
H314 Causes severe skin burns and eye damage100% of notifiers
H318 Causes serious eye damage100% of notifiers

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

Precautionary statements

P234, P260, P264, P264+P265, P280, P301+P330+P331, P302+P361+P354, P304+P340, P305+P354+P338, P316, P317, P321, P363, P390, P405, P406, P501

Identifiers

CAS number

35335-16-1

SMILES

C1=C(C(=CC(=C1Br)CBr)Br)CBr

InChIKey

UOCMTKLYRROETA-UHFFFAOYSA-N

InChI

InChI=1S/C8H6Br4/c9-3-5-1-7(11)6(4-10)2-8(5)12/h1-2H,3-4H2

Weigh it out

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

Names and synonyms

1 names

1,4-Dibromo-2,5-bis(brommethyl)benzene

Work with 1,4-Dibromo-2,5-bis(bromomethyl)benzene

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-Bromo-4,5-dimethoxybenzyl bromide53207-00-458 % similar 1,2,4,5-Tetrakis(bromomethyl)benzene15442-91-856 % similar 2-Bromobenzyl bromide3433-80-555 % similar 1-Bromo-2-(bromomethyl)-4-fluorobenzene112399-50-554 % similar 2-Bromo-1-(bromomethyl)-4-fluorobenzene61150-57-054 % similar 2-Bromo-5-chlorobenzyl bromide66192-24-354 % similar 2-Bromo-5-methoxybenzyl bromide19614-12-150 % similar 2-Bromo-5-(trifluoromethyl)benzyl bromide875664-32-748 % similar

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

Same formula

Tetrabromo-O-xylene13209-15-9 1,4-Bis(dibromomethyl)benzene1592-31-0 2,3,5,6-Tetrabromo-p-xylene23488-38-2 1,3-Bis(dibromomethyl)benzene36323-28-1

Elsewhere

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