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1,6-Dibromohexane

1,6-Dibromohexane structure

CAS No:
629-03-8
Formula:
C6H12Br2
Chemical Name:
1,6-Dibromohexane
Synonyms:
Hexane,1,6-dibromo-;1,6-Dibromohexane;1,6-Dibromo-n-hexane;Hexamethylene dibromide;α,ω-Dibromohexane;NSC 7306;625084-40-4
Categories:
Pharmaceutical Intermediates > Bulk Drug Intermediates

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Description

colourless or pale yellow liquid

1,6-Dibromohexane Basic Attributes

Molecular Weight：

243.97

Exact Mass：

243.97

EC Number：

211-067-2

UNII：

7L71Q7Y230

NSC Number：

7306

DSSTox ID：

DTXSID4044452

HScode：

2903299090

Characteristics

PSA：

XLogP3：

3.2

Appearance：

Colorless or pale yellow liquid.

Density：

1.6041 g/cm³ @ Temp: 20 °C

Melting Point：

-2.3 °C

Boiling Point：

245.5 °C

Flash Point：

110.8±17.7 °C

Refractive Index：

1.500

Water Solubility：

H2O: insoluble

Storage Conditions：

Store in a tightly closed container. Store in a cool, dry, well-ventilated area away from incompatible substances.

Vapor Pressure：

<1 hPa (20 °C)

Toxicity：

LD50 orally in Rabbit: 1800 mg/kg LD50 dermal Rabbit > 2000 mg/kg

Safety Information

Packing level：

Ⅲ

Hazard category：

Transport codes：

2810

wgk germany：

hazard class code：

6.1

safety instructions：

S36-S45-S61

RTECS Number：

MO1515000

Marks：

T:Toxic

Stability/Shelf Life：

Stable. Incompatible with strong oxidizing agents.

Precautionary statement(s)：

P264-P280-P301 + P310

Hazard Statements：

H300-H317

GHS Classification：

|Danger|H300 (69.44%): Fatal if swallowed [Danger Acute toxicity, oral]|P261, P264, P270, P272, P273, P280, P301+P310, P301+P312, P302+P352, P321, P330, P333+P313, P363, P391, P405, and P501|Aggregated GHS information provided by 124 companies from 11 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.

1,6-Dibromohexane Use and Manufacturing

Manufacturing Info：

Hexane, 1,6-dibromo-: ACTIVE

Computed Properties

Molecular Weight:243.97
XLogP3:3.2
Rotatable Bond Count:5
Exact Mass:243.92853
Monoisotopic Mass:241.93058
Heavy Atom Count:8
Complexity:31.5
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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