1,2,3,4-Tetrabromobutane

C₄H₆Br₄CAS 1529-68-6373.71 g/mol

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Properties

Molecular formula: C₄H₆Br₄
Molar mass: 373.71 g/mol
Exact mass: 369.7203 Da
Melting point: 118 °C
Boiling point: 118–123 °C (at 10 Torr)
logP: 3.30Crippen estimate
Polar surface area: 0.0 Å²
H-bond donors / acceptors: 0 / 0
Rotatable bonds: 3

Hazards

Danger

H315 Causes skin irritation100% of notifiers
H318 Causes serious eye damage100% of notifiers
H335 May cause respiratory irritation100% of notifiers
H411 Toxic to aquatic life with long lasting effects100% of notifiers

Aggregated from 39 ECHA notifications, via PubChem; a share says how many notifiers assign that statement.

Precautionary statements

P261, P264, P264+P265, P271, P273, P280, P302+P352, P304+P340, P305+P354+P338, P317, P319, P321, P332+P317, P362+P364, P391, P403+P233, P405, P501

Identifiers

CAS number

1529-68-6

SMILES

BrCC(Br)C(Br)CBr

InChIKey

HGRZLIGHKHRTRE-UHFFFAOYSA-N

InChI

InChI=1S/C4H6Br4/c5-1-3(7)4(8)2-6/h3-4H,1-2H2

Weigh it out

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

Names and synonyms

4 names

Butane, 1,2,3,4-tetrabromo-
Tetrabromobutane
Fire guard 5000
NSC 505

Work with 1,2,3,4-Tetrabromobutane

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

1,1,2-Tribromoethane78-74-047 % similar 1,2,3-Tribromopropane96-11-747 % similar Hexabromocyclododecane3194-55-643 % similar 1,2-Dibromopropane78-75-139 % similar 1,2-Dibromocyclohexane5401-62-738 % similar (Bromomethyl)cyclopropane7051-34-538 % similar trans-1,2-Dibromocyclohexane7429-37-038 % similar Rel-(2R,3R)-2,3-Dibromo-1,4-butanediol1947-58-635 % similar

Tanimoto similarity of circular fingerprints over the whole catalogue.

All similar compounds

Elsewhere

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