1,4-Dibromo-2,5-dimethylbenzene - CAS 1074-24-4

Name: 1,4-Dibromo-2,5-dimethylbenzene
Brand: BOC Sciences
Rating: 5 (1 reviews)

Technical Data

IUPAC Name:	1,4-dibromo-2,5-dimethylbenzene
Description:	1,4-Dibromo-2,5-dimethylbenzene (CAS# 1074-24-4) is also used in the preparation of polyfunctional aryl azides (e.g. 1,5-diphenylcarbazide [D487350]) from aryl triazenes.
Molecular Weight:	263.96
Molecular Formula:	C8H8Br2
Canonical SMILES:	CC1=CC(=C(C=C1Br)C)Br
InChI:	InChI=1S/C8H8Br2/c1-5-3-8(10)6(2)4-7(5)9/h3-4H,1-2H3
InChI Key:	QENIALCDPFDFHX-UHFFFAOYSA-N
Boiling Point:	261 °C
Melting Point:	72-75 °C
Purity:	95 %
Density:	1.71 g/cm³
Appearance:	White to slightly yellow shiny crystalline powder
Storage:	Store in a tightly closed container. Store in a cool, dry, well-ventilated area away from incompatible substances.
MDL:	MFCD00000091
LogP:	3.82840

GHS Hazard Statement:	H315 (100%): Causes skin irritation [Warning Skin corrosion/irritation]; H319 (100%): 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]; H411 (84.44%): Toxic to aquatic life with long lasting effects [Hazardous to the aquatic environment, long-term hazard]
Precautionary Statement:	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
Signal Word:	Warning

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Complexity:	99.8
Compound Is Canonicalized:	Yes
Covalently-Bonded Unit Count:	1
Defined Atom Stereocenter Count:	0
Defined Bond Stereocenter Count:	0
Exact Mass:	263.89723
Formal Charge:	0
Heavy Atom Count:	10
Hydrogen Bond Acceptor Count:	0
Hydrogen Bond Donor Count:	0
Isotope Atom Count:	0
Monoisotopic Mass:	261.89928
Rotatable Bond Count:	0
Topological Polar Surface Area:	0
Undefined Atom Stereocenter Count:	0
Undefined Bond Stereocenter Count:	0
XLogP3:	4