2-Amino-5-bromobenzonitrile - CAS 39263-32-6

Name: 2-Amino-5-bromobenzonitrile
Brand: BOC Sciences
Rating: 5 (1 reviews)

Catalog:	BB023920
Product Name:	2-Amino-5-bromobenzonitrile
CAS:	39263-32-6
Synonyms:	2-amino-5-bromobenzonitrile

Technical Data

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Computed Properties

IUPAC Name:	2-amino-5-bromobenzonitrile
Description:	2-Amino-5-bromobenzonitrile (CAS# 39263-32-6) is a useful research chemical.
Molecular Weight:	197.03
Molecular Formula:	C7H5BrN2
Canonical SMILES:	C1=CC(=C(C=C1Br)C#N)N
InChI:	InChI=1S/C7H5BrN2/c8-6-1-2-7(10)5(3-6)4-9/h1-3H,10H2
InChI Key:	OATYCBHROMXWJO-UHFFFAOYSA-N
Boiling Point:	288.4 °C at 760 mmHg
Melting Point:	93-98 °C
Purity:	98 %
Density:	1.68 g/cm³
Appearance:	White to light yellow crystal powder
MDL:	MFCD00158946
LogP:	2.48418

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Related Functional Groups

Amines and Anilines

[1550-50-1]C4H7F4N
1,1,2,2-Tetrafluoro-N,N-dimethylethanamine
[1082066-00-9]C7H8N2O
1-Cyclopropyl-1H-pyrazole-4-carbaldehyde
[438616-66-1]C14H20N2O
2-(4-Tert-Butylphenyl)cyclopropanecarbohydrazide
[1431966-58-3]C8H18Cl2F2N2O
2,2-Difluoro-N-(2-morpholin-4-ylethyl)ethanamine dihydrochloride
[1011396-69-2]C12H17F2NO2
2,2-Difluoro-N-(4-methoxy-3-(methoxymethyl)benzyl)ethanamine
[151585-93-2]C7H6FNO
2-Amino-6-fluorobenzaldehyde

Nitrogen Compounds

[89908-23-6]C23H22N2O5
2-Propenoic acid, 2-(3',3'-dimethyl-6-nitrospiro[2H-1-benzopyran-2,2'-[2H]indol]-1'(3'H)-yl)ethyl ester
[333311-69-6]C12H12BrN3O2
1-(4-Bromobenzyl)-3,5-dimethyl-4-nitro-1H-pyrazole
[1281984-38-0]C8H10N4O4
1-Cyclopentyl-3,5-dinitro-1H-pyrazole
[2006278-12-0]C13H9BrN2O
2-[(5-Bromo-3-pyridyl)oxy]-2-phenylacetonitrile
[916792-07-9]C8H5BrFN
2-Bromo-4-fluoro-5-methylbenzonitrile
[1170836-29-9]C12H12F3N5
3-(1',3'-Dimethyl-5-(trifluoromethyl)-1'H,2H-[3,4'-bipyrazol]-2-yl)propanenitrile

GHS Hazard Statement:	H302 (93.02%): Harmful if swallowed [Warning Acute toxicity, oral]
Precautionary Statement:	P261, P264, P270, P271, P272, P280, P301+P312, P302+P352, P304+P312, P304+P340, P312, P321, P322, P330, P333+P313, P363, and P501
Signal Word:	Warning

Publication Number	Title	Priority Date
CN-112778219-A	Method for preparing 2,4- (1H,3H) -quinazoline diketone compound	20210127
CN-112645887-A	Preparation method of quinazolinone derivative	20201221
JP-2021105200-A	Metal surface treatment agent, metal material having a film, and its manufacturing method	20191226
JP-6779357-B1	Metal surface treatment agent, metal material having a film, and its manufacturing method	20191226
WO-2021131374-A1	Metal surface-treating agent, and metal material with coating film and method for manufacturing same	20191226

Complexity:	160
Compound Is Canonicalized:	Yes
Covalently-Bonded Unit Count:	1
Defined Atom Stereocenter Count:	0
Defined Bond Stereocenter Count:	0
Exact Mass:	195.96361
Formal Charge:	0
Heavy Atom Count:	10
Hydrogen Bond Acceptor Count:	2
Hydrogen Bond Donor Count:	1
Isotope Atom Count:	0
Monoisotopic Mass:	195.96361
Rotatable Bond Count:	0
Topological Polar Surface Area:	49.8 Å²
Undefined Atom Stereocenter Count:	0
Undefined Bond Stereocenter Count:	0
XLogP3:	2.2