Home Other Building Blocks m-Bromoaniline

m-Bromoaniline

CAS No.:
591-19-5
Catalog Number:
AG00371A
Molecular Formula:
C6H6BrN
Molecular Weight:
172.0225
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
5g
98%
In Stock USA
United States
$13
- +
25g
98%
In Stock USA
United States
$19
- +
100g
98%
In Stock USA
United States
$50
- +
500g
98%
In Stock USA
United States
$188
- +
Product Description
Catalog Number:
AG00371A
Chemical Name:
m-Bromoaniline
CAS Number:
591-19-5
Molecular Formula:
C6H6BrN
Molecular Weight:
172.0225
MDL Number:
MFCD00007757
IUPAC Name:
3-bromoaniline
InChI:
InChI=1S/C6H6BrN/c7-5-2-1-3-6(8)4-5/h1-4H,8H2
InChI Key:
DHYHYLGCQVVLOQ-UHFFFAOYSA-N
SMILES:
Nc1cccc(c1)Br
EC Number:
209-704-4
NSC Number:
10298
Properties
Complexity:
74.9  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
170.968g/mol
Formal Charge:
0
Heavy Atom Count:
8  
Hydrogen Bond Acceptor Count:
1  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
172.025g/mol
Monoisotopic Mass:
170.968g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
26A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.1  
Literature
Title Journal
2-[(3-Bromo-anilino)meth-yl]-1,2-benzo-thia-zol-3(2H)-one. Acta crystallographica. Section E, Structure reports online 20120501
Double C-H functionalization in sequential order: direct synthesis of polycyclic compounds by a palladium-catalyzed C-H alkenylation-arylation cascade. Chemistry (Weinheim an der Bergstrasse, Germany) 20120423
(2Z)-3-(3-Bromo-anilino)-1-(5-hy-droxy-3-methyl-1-phenyl-1H-pyrazol-4-yl)but-2-en-1-one. Acta crystallographica. Section E, Structure reports online 20120301
Muscarinic receptor subtypes and signalling involved in the attenuation of isoprenaline-induced rat urinary bladder relaxation. Naunyn-Schmiedeberg's archives of pharmacology 20111201
Design, synthesis and evaluation of 2-amino-4-m-bromoanilino-6-arylmethyl-7H-pyrrolo[2,3-d]pyrimidines as tyrosine kinase inhibitors and antiangiogenic agents. Bioorganic & medicinal chemistry 20100715
3-Bromo-anilinium picrate. Acta crystallographica. Section E, Structure reports online 20091201
(E)-3-[(3-Bromo-phen-yl)imino-meth-yl]benzene-1,2-diol: a combined X-ray and computational structural study. Acta crystallographica. Section E, Structure reports online 20091001
N-(3-Bromo-phen-yl)-3,4,5-trimethoxy-benzamide. Acta crystallographica. Section E, Structure reports online 20090701
2-[(3-Bromo-phen-yl)imino-meth-yl]phenol. Acta crystallographica. Section E, Structure reports online 20080901
One pot synthesis of alpha-aminophosphonates containing bromo and 3,4,5-trimethoxybenzyl groups under solvent-free conditions. Molecules (Basel, Switzerland) 20070207
[Separation of isomeric compounds by high speed countercurrent chromatography]. Se pu = Chinese journal of chromatography 20061101
Two-step hollow fiber-based, liquid-phase microextraction combined with high-performance liquid chromatography: a new approach to determination of aromatic amines in water. Journal of chromatography. A 20050805
Antiangiogenic and antitumor agents. Design, synthesis, and evaluation of novel 2-amino-4-(3-bromoanilino)-6-benzylsubstituted pyrrolo[2,3-d]pyrimidines as inhibitors of receptor tyrosine kinases. Bioorganic & medicinal chemistry 20031117
Properties