Methyldibromo glutaronitrile

C₆H₆Br₂N₂CAS 35691-65-7265.94 g/mol

Open in Covalent MOL file

Alkyl halide Nitrile

Properties

Molecular formula: C₆H₆Br₂N₂
Molar mass: 265.94 g/mol
Exact mass: 263.8898 Da
Melting point: 52 °C
Boiling point: 212 °C
Water solubility: 2.12 g/L
logP: 2.34Crippen estimate
Polar surface area: 47.6 Å²
H-bond donors / acceptors: 0 / 2
Rotatable bonds: 3

Hazards

Danger

H302 Harmful if swallowed98.5% of notifiers
H315 Causes skin irritation81% of notifiers
H317 May cause an allergic skin reaction57.7% of notifiers
H318 Causes serious eye damage89% of notifiers
H400 Very toxic to aquatic life42.9% of notifiers
H411 Toxic to aquatic life with long lasting effects12.7% of notifiers

Aggregated from 1,350 ECHA notifications, via PubChem; a share says how many notifiers assign that statement.

Precautionary statements

P261, P264, P264+P265, P270, P272, P273, P280, P301+P317, P302+P352, P305+P354+P338, P317, P321, P330, P332+P317, P333+P317, P362+P364, P391, P501

Identifiers

CAS number

35691-65-7

SMILES

N#CCCC(Br)(C#N)CBr

InChIKey

DHVLDKHFGIVEIP-UHFFFAOYSA-N

InChI

InChI=1S/C6H6Br2N2/c7-4-6(8,5-10)2-1-3-9/h1-2,4H2

Weigh it out

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

Names and synonyms

16 names · show all

Pentanedinitrile, 2-bromo-2-(bromomethyl)-
2-Bromo-2-(bromomethyl)pentanedinitrile
2-Bromo-2-(bromomethyl)glutaronitrile
1,2-Dibromo-2,4-dicyanobutane
Tektamer 38
Tektamer 38AD
BBMG
1-Bromo-1-(bromomethyl)-1,3-propanedicarbonitrile
Methyldibromoglutaronitrile
Tektamer
MDBGN
Tuopai DM 01
DBDCB
Bromothalonil
Merguard 1105
Cosmoguard

Work with Methyldibromo glutaronitrile

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 Boiling point under vacuumAt any pressure, from its normal boiling point Isotope patternExact mass and the mass spectrum pattern

Similar compounds

3-Bromopropionitrile2417-90-536 % similar 4-Bromobutyronitrile5332-06-933 % similar 5-Bromovaleronitrile5414-21-132 % similar Succinonitrile110-61-232 % similar 7-Bromoheptanenitrile20965-27-931 % similar 6-Bromohexanenitrile6621-59-631 % similar Tris(cyanoethyl)phosphine4023-53-431 % similar

Tanimoto similarity of circular fingerprints over the whole catalogue.

All similar compounds

Same formula

2,5-Dibromo-1,4-phenylenediamine25462-61-7 3,5-Dibromo-4-methylpyridin-2-amine3430-29-3 4,5-Dibromo-1,2-phenylenediamine49764-63-8 3,6-Dibromo-1,2-benzenediamine69272-50-0 2-Amino-3,5-dibromo-6-methylpyridine91872-10-5

Elsewhere

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