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Product No: AB0960

1,4-Dibromobenzene, 98%

Name: 1,4-Dibromobenzene
Brand: Chempure

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CAS Number

106-37-6

Molecular Weight

235.90

Formula

C6H4Br2

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IUPAC name	1,4-dibromobenzene
canonical smiles	C1=CC(=CC=C1Br)Br
inchi	InChI=1S/C6H4Br2/c7-5-1-2-6(8)4-3-5/h1-4H
inchi key	SWJPEBQEEAHIGZ-UHFFFAOYSA-N
molecular formula	C6H4Br2
synonyms	1,4-Dibromobenzene 106-37-6 P-DIBROMOBENZENE Benzene, 1,4-dibromo- p-Bromophenyl bromide
Compound Description	1,4-dibromobenzene is a dibromobenzene.

Computed Properties

Molecular Weight:	235.90 g/mol
XLogP3:	3.8
Hydrogen Bond Donor Count:	0
Hydrogen Bond Acceptor Count:	0
Rotatable Bond Count:	0
Exact Mass:	235.86593 g/mol
Monoisotopic Mass:	233.86798 g/mol
Topological Polar Surface Area:	0 Å²
Heavy Atom Count:	8
Formal Charge:	0
Complexity:	54.9
Isotope Atom Count:	0
Defined Atom Stereocenter Count:	0
Undefined Atom Stereocenter Count:	0
Defined Bond Stereocenter Count:	0
Undefined Bond Stereocenter Count:	0
Covalently-Bonded Unit Count:	1
Compound Is Canonicalized:	Yes

Related Compounds

Bromobenzene

Cumene

alpha-PHELLANDRENE

p-CYMENE

gamma-Terpinene

alpha-Terpinene

1,4-Dibromobenzene

alpha-PHELLANDRENE, (-)-

4-Bromotoluene

1,4-Diethylbenzene

2-Bromotoluene

4-tert-Butyltoluene

1,3-Diethylbenzene

Beta-Phellandrene

3-Bromotoluene

hazard signal	Warning
hazard classes and categories	Skin Irrit. 2 (98.48%) Eye Irrit. 2 (98.48%) STOT SE 3 (100%) Aquatic Acute 1 (68.18%) Aquatic Chronic 2 (21.21%) Specific target organ toxicity - Repeated exposure - Category 1 (kidney)_x000D_ Category 2 (liver) Hazardous to the aquatic environment (Acute) - Category 1 Hazardous to the aquatic environment (Long-term) - Category 1
precautionary statement codes	P261, P264, P264+P265, P271, P273, P280, P302+P352, P304+P340, P305+P351+P338, P319, P321, P332+P317, P337+P317, P362+P364, P391, P403+P233, P405, and P501
hazard statements	H315 (98.48%): Causes skin irritation [Warning Skin corrosion/irritation] H319 (98.48%): Causes serious eye irritation [Warning Serious eye damage/eye irritation] H335 (100%): May cause respiratory irritation [Warning Specific target organ toxicity, single exposure; Respiratory tract irritation] H400 (68.18%): Very toxic to aquatic life [Warning Hazardous to the aquatic environment, acute hazard] H411 (21.21%): Toxic to aquatic life with long lasting effects [Hazardous to the aquatic environment, long-term hazard]
hazards summary	A skin and eye irritant. An irritant. May cause kidney and liver injury. See Bromobenzene. See p-Dichlorobenzene.

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About this item

Documentation

Certificate of Analysis

Lot Number

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CAS #

*This document is like a lab demo—an example Certificate of Analysis (COA) that showcases what a COA looks like but may not match the latest batch in all its glory. Think of it as a chemistry experiment: close, but not quite the final reaction!

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About this item

IUPAC name	1,4-dibromobenzene
canonical smiles	C1=CC(=CC=C1Br)Br
inchi	InChI=1S/C6H4Br2/c7-5-1-2-6(8)4-3-5/h1-4H
inchi key	SWJPEBQEEAHIGZ-UHFFFAOYSA-N
molecular formula	C6H4Br2
synonyms	1,4-Dibromobenzene 106-37-6 P-DIBROMOBENZENE Benzene, 1,4-dibromo- p-Bromophenyl bromide
Compound Description	1,4-dibromobenzene is a dibromobenzene.

Computed Properties

Molecular Weight:	235.90 g/mol
XLogP3:	3.8
Hydrogen Bond Donor Count:	0
Hydrogen Bond Acceptor Count:	0
Rotatable Bond Count:	0
Exact Mass:	235.86593 g/mol
Monoisotopic Mass:	233.86798 g/mol
Topological Polar Surface Area:	0 Å²
Heavy Atom Count:	8
Formal Charge:	0
Complexity:	54.9
Isotope Atom Count:	0
Defined Atom Stereocenter Count:	0
Undefined Atom Stereocenter Count:	0
Defined Bond Stereocenter Count:	0
Undefined Bond Stereocenter Count:	0
Covalently-Bonded Unit Count:	1
Compound Is Canonicalized:	Yes

Related Compounds

Bromobenzene

Cumene

alpha-PHELLANDRENE

p-CYMENE

gamma-Terpinene

alpha-Terpinene

1,4-Dibromobenzene

alpha-PHELLANDRENE, (-)-

4-Bromotoluene

1,4-Diethylbenzene

2-Bromotoluene

4-tert-Butyltoluene

1,3-Diethylbenzene

Beta-Phellandrene

3-Bromotoluene

hazard signal	Warning
hazard classes and categories	Skin Irrit. 2 (98.48%) Eye Irrit. 2 (98.48%) STOT SE 3 (100%) Aquatic Acute 1 (68.18%) Aquatic Chronic 2 (21.21%) Specific target organ toxicity - Repeated exposure - Category 1 (kidney)_x000D_ Category 2 (liver) Hazardous to the aquatic environment (Acute) - Category 1 Hazardous to the aquatic environment (Long-term) - Category 1
precautionary statement codes	P261, P264, P264+P265, P271, P273, P280, P302+P352, P304+P340, P305+P351+P338, P319, P321, P332+P317, P337+P317, P362+P364, P391, P403+P233, P405, and P501
hazard statements	H315 (98.48%): Causes skin irritation [Warning Skin corrosion/irritation] H319 (98.48%): Causes serious eye irritation [Warning Serious eye damage/eye irritation] H335 (100%): May cause respiratory irritation [Warning Specific target organ toxicity, single exposure; Respiratory tract irritation] H400 (68.18%): Very toxic to aquatic life [Warning Hazardous to the aquatic environment, acute hazard] H411 (21.21%): Toxic to aquatic life with long lasting effects [Hazardous to the aquatic environment, long-term hazard]
hazards summary	A skin and eye irritant. An irritant. May cause kidney and liver injury. See Bromobenzene. See p-Dichlorobenzene.

Product No: AB0960

1,4-Dibromobenzene, 98%

Product No: AB0960

About this item

NAME AND IDENTIFIERS

CHEMICAL AND PHYSICAL PROPERTIES

Related Compounds

SAFETY AND HAZARDS

About this item

Documentation

Certificate of Analysis

Require a Sample Certificate of Analysis (COA) ?

Reviews

Product No: AB0960

About this item

NAME AND IDENTIFIERS

CHEMICAL AND PHYSICAL PROPERTIES

Related Compounds

SAFETY AND HAZARDS

Require a Sample Certificate of Analysis (COA) ?