CAS 24774-58-1 2,5-Dibromohexane (HCID 91232)

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Basic information

CAS: 24774-58-1
Standard SMILES: CC(Br)CCC(C)Br
InChIKey: MQYLGFBWOZXHHF-UHFFFAOYSA-N
Molecular formula: C6H12Br2
Average molar mass: 243.97 g/mol
Monoisotopic mass: 241.93057458

Names & identifiers

Preferred name: 2,5-Dibromohexane
IUPAC: 2,5-dibromohexane
English name: 2,5-Dibromohexane
Molecular formula: C6H12Br2
Molecular weight: 243.97

Names & synonyms

2,5-DibromohexaneHexane, 2,5-dibromo-EINECS 246-457-1DTXSID00884665RefChem:82775DTXCID201024095246-457-1MQYLGFBWOZXHHF-UHFFFAOYSA-N24774-58-1MFCD000391772.5-Dibromohexane2,5-Dibromohexane, erythro + threo

Show more names

dibromohexane2,5-dibromo-hexan2,5-Dibromohexane,97%2,5-Dibromohexane, erythro + threo, 97%2,5-Dibromohexane (mixture of diastereomers)2,5-Dibromohexane(mixtureofdiastereoisomers)>2,5-DibroMohexane (Mixture of diastereoisoMers)

2,5-dibromo-hexane25-Dibromohexane2.5-DibromhexanSCHEMBL421767SCHEMBL27879372AKOS025294992AS-57356SY050065

Database identifiers

CAS: 24774-58-1
PubChem CID: 91232
DTXSID: DTXSID00884665
EC Number: 246-457-1
Nikkaji: J88.294A

Properties

Computed structural properties

XLogP: 3.3
Topological polar surface area: 0 Å²
Hydrogen bond donors: 0
Hydrogen bond acceptors: 0
Rotatable bonds: 3
Heavy atoms: 8
Formal charge: 0
Complexity: 46.5

Experimental & physicochemical properties

SpringerMaterials PropertiesDensity

Physicochemical properties

Melting point: 38 °C · 38°C
Boiling point: 78 °C · 78 °C
Density: 1 · 1,58 g/cm3
refractive index: 1.5 · 1.5-1.502
Flash point: 88 · 88-89°C/13mm
form: clear liquid
color: Colorless to Light orange to Yellow
BRN: 1732460 · 1732460
Dielectric constant: 5 · 5.0(24℃)
CAS DataBase Reference: 24774 · 24774-58-1(CAS DataBase Reference)
NIST Chemistry Reference: 2 · Hexane, 2,5-dibromo-(24774-58-1)
EPA Substance Registry System: 2 · Hexane, 2,5-dibromo- (24774-58-1)

Safety & regulation

GHS classification

GHS Classification · 4 items

Warning

H315 (100%): Causes skin irritation [Warning Skin corrosion/irritation]

P264, P264+P265, P280, P302+P352, P305+P351+P338, P321, P332+P317, P337+P317, and P362+P364 (click each P-code to see the statement)

Aggregated GHS information provided per 5 reports by companies from 2 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.

Hazard information

Hazard Classes and CategoriesSkin Irrit. 2 (100%)

Safety data

tsca: TSCA listed
hs_code: 29033919
risk_code: 36/38-36/37/38
Signal word: Warning
Symbol(GHS): GHS07
hazard_code: Xi
safety_code: 26-36/37/39-37/39
Hazard statements: H315-H319
Precautionary statements: P280a-P305+P351+P338-P321-P332+P313-P337+P313-P264-P280-P302+P352+P332+P313+P362+P364-P305+P351+P338+P337+P313