3,5-Dibromonitrobenzene - CAS 6311-60-0

Catalog:	BB032006
Product Name:	3,5-Dibromonitrobenzene
CAS:	6311-60-0
Synonyms:	1,3-dibromo-5-nitrobenzene; 1,3-dibromo-5-nitrobenzene

Technical Data

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Computed Properties

IUPAC Name:	1,3-dibromo-5-nitrobenzene
Description:	3,5-Dibromonitrobenzene (CAS# 6311-60-0) is a useful research chemical.
Molecular Weight:	280.90
Molecular Formula:	C6H3Br2NO2
Canonical SMILES:	C1=C(C=C(C=C1Br)Br)[N+](=O)[O-]
InChI:	InChI=1S/C6H3Br2NO2/c7-4-1-5(8)3-6(2-4)9(10)11/h1-3H
InChI Key:	ZWBHGBWABMAWOV-UHFFFAOYSA-N
Boiling Point:	290.5 °C at 760 mmHg
Density:	2.101 g/cm³
Appearance:	Orange to yellow powder
MDL:	MFCD00092529
LogP:	3.64300

Publication Number	Title	Priority Date
CN-113092384-A	Preparation and detection method of micro-fluidic paper chip for rapidly detecting potassium in blood	20210414
JP-2021070684-A	Method for producing halogen compounds	20191030
CN-110590570-A	Method for preparing halogenated p-aminophenol by catalytic hydrogenation of non-para-halogenated nitrobenzene	20191010
CN-107417611-A	One kind 3ï¼ˆ4 methoxyphenylsï¼‰The synthetic method of the bromoquinoline of 6 methoxyl group, 4 chlorine 5,7 2	20170725
CN-107459481-A	One kind 3ï¼ˆ4 methoxyphenylsï¼‰The synthetic method of the bromoquinoline of 6 methoxyl group, 4 chlorine 5,7 2	20170725

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GHS Hazard Statement:	H302 (92.68%): Harmful if swallowed [Warning Acute toxicity, oral]
Precautionary Statement:	P264, P270, P301+P312, P330, and P501
Signal Word:	Warning

Complexity:	149
Compound Is Canonicalized:	Yes
Covalently-Bonded Unit Count:	1
Defined Atom Stereocenter Count:	0
Defined Bond Stereocenter Count:	0
Exact Mass:	280.85100
Formal Charge:	0
Heavy Atom Count:	11
Hydrogen Bond Acceptor Count:	2
Hydrogen Bond Donor Count:	0
Isotope Atom Count:	0
Monoisotopic Mass:	278.85305
Rotatable Bond Count:	0
Topological Polar Surface Area:	45.8 Å²
Undefined Atom Stereocenter Count:	0
Undefined Bond Stereocenter Count:	0
XLogP3:	3.3