1,7-Dibromoheptane

Basic Information

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CAS Number

4549-31-9

Molecular Formula

C7H14Br2

Molecular Weight

258 g/mol

Chemical Classification

Basic Chemical Raw Materials Organic Chemicals Hydrocarbons

Basic Physical Properties

Melting Point

41.7°C

Boiling Point

263°C

Refractive Index

n20/D 1.503(lit.)

SMILES

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C(CCCBr)CCCBr

InChI

InChI=1S/C7H14Br2/c8-6-4-2-1-3-5-7-9/h1-7H2

InChIKey

LVWSZGCVEZRFBT-UHFFFAOYSA-N

LogP

3.726700000000003

Topological Polar Surface Area

0.0 Å²

Hydrogen Bond Donor/Acceptor

0 / 0

Complexity

40.2

Safety Information

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GHS Hazard Pictograms

H300

H319

Hazard Statement

H300 Fatal if swallowed
Acute toxicity, oral

H319 Causes serious eye irritation
Serious eye damage/eye irritation

Stability

Stable. Incompatible with strong bases, strong oxidizing agents.

Synonyms & References

English

NSC-56149
SCHEMBL31090
CS-W010166
A826824
Dibromo-1,7 heptane
LVWSZGCVEZRFBT-UHFFFAOYSA-
1,9-Dibromnonan;1,9-dibromo-nonan;Nonane,1,9-dibromo-;1,9-Dibromononane
AKOS015903053
1,7-dibromo-heptane
AMY11216
FT-0607023
1,7-Dibromoheptane
EN300-1073276
A24628
NS00031539
MFCD00000274
DTXSID6063519
W-106133
Heptane,7-dibromo-
D2119
Heptane, 1,7-dibromo-
AI3-11015
NCIOpen2_002541
1,7-Dibromoheptane, 97%
SY050897
InChI=1/C7H14Br2/c8-6-4-2-1-3-5-7-9/h1-7H2
4549-31-9
NSC56149
EINECS 224-910-4
NSC 56149
STR06984

MDL Number

MFCD00000274

Customs Code

2903399090

FAQ

What regulatory guidelines apply to 1,7-Dibromoheptane (CAS: 4549-31-9)?

1,7-Dibromoheptane (CAS: 4549-31-9) falls under various regulatory guidelines including the Globally Harmonized System of Classification and Labelling of Chemicals (GHS), REACH regulations (in the EU), and FDA/EPA requirements for industrial and commercial use. It is classified as a hazard class 3 flammable liquid and a skin and eye irritant under GHS. Users should comply with local and national regulations for storage, handling, and disposal.

Are there alternatives to 1,7-Dibromoheptane (CAS: 4549-31-9) in synthesis?

Alternatives to 1,7-Dibromoheptane (CAS: 4549-31-9) include other brominated alkanes such as 1,6-Dibromoheptane and brominated derivatives of other heptane isomers. Other substitute reagents like chlorinated or iodinated heptanes can also be considered depending on the specific synthetic needs. These alternatives offer similar reactivity but with different physical properties and safety profiles.

What is the market or research trend for 1,7-Dibromoheptane (CAS: 4549-31-9)?

1,7-Dibromoheptane (CAS: 4549-31-9) is currently experiencing steady market demand, particularly in the rubber vulcanization sector and as a flame retardant additive. Research trends are focusing on its use in developing flame retardant formulations and as a precursor in organic synthesis. Market trends indicate growing interest in sustainable and eco-friendly alternatives, which is driving innovation in its application and formulation.

How should waste containing 1,7-Dibromoheptane (CAS: 4549-31-9) be handled?

Waste containing 1,7-Dibromoheptane (CAS: 4549-31-9) should be collected in appropriate containers and stored in a well-ventilated area away from sources of ignition. The waste should be disposed of by a licensed hazardous waste disposal facility. Incineration under controlled conditions is a common method, but it must be done in accordance with local regulations. Environmental precautions include ensuring no spillage and proper neutralization of any residual chemicals before disposal to prevent environmental contamination.