Home Halogens 2-Amino-3-(3-bromo-4-hydroxyphenyl)propanoic acid

2-Amino-3-(3-bromo-4-hydroxyphenyl)propanoic acid

CAS No.:
54788-30-6
Catalog Number:
AG003J5H
Molecular Formula:
C9H10BrNO3
Molecular Weight:
260.0846
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
250mg
95%
In Stock USA
United States
$108
- +
1g
95%
In Stock USA
United States
$270
- +
Product Description
Catalog Number:
AG003J5H
Chemical Name:
2-Amino-3-(3-bromo-4-hydroxyphenyl)propanoic acid
CAS Number:
54788-30-6
Molecular Formula:
C9H10BrNO3
Molecular Weight:
260.0846
MDL Number:
MFCD09842061
IUPAC Name:
2-amino-3-(3-bromo-4-hydroxyphenyl)propanoic acid
InChI:
InChI=1S/C9H10BrNO3/c10-6-3-5(1-2-8(6)12)4-7(11)9(13)14/h1-3,7,12H,4,11H2,(H,13,14)
InChI Key:
HGWOSUKIFQMEIF-UHFFFAOYSA-N
SMILES:
OC(=O)C(Cc1ccc(c(c1)Br)O)N
Properties
Complexity:
212  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
258.984g/mol
Formal Charge:
0
Heavy Atom Count:
14  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
3  
Isotope Atom Count:
0
Molecular Weight:
260.087g/mol
Monoisotopic Mass:
258.984g/mol
Rotatable Bond Count:
3  
Topological Polar Surface Area:
83.6A^2
Undefined Atom Stereocenter Count:
1  
Undefined Bond Stereocenter Count:
0
XLogP3:
-1.7  
Literature
Title Journal
Association of brominated proteins and changes in protein expression in the rat kidney with subcarcinogenic to carcinogenic doses of bromate. Toxicology and applied pharmacology 20131015
Identifying peroxidases and their oxidants in the early pathology of cystic fibrosis. Free radical biology & medicine 20101115
Bromotyrosines in sputum proteins and treatment effects of terbutaline and budesonide in asthma. Annals of allergy, asthma & immunology : official publication of the American College of Allergy, Asthma, & Immunology 20091001
Simultaneous detection and quantification of 3-nitrotyrosine and 3-bromotyrosine in human urine by stable isotope dilution liquid chromatography tandem mass spectrometry. Toxicology letters 20080901
Capillary electrophoresis for monitoring dityrosine and 3-bromotyrosine synthesis. Journal of chromatography. A 20060127
Characterization of oxidative pathways in chronic rhinosinusitis and sinonasal polyposis. American journal of rhinology 20060101
Nonenzymatic preparative-scale synthesis of dityrosine and 3-bromotyrosine. Analytical biochemistry 20041101
Urinary 3-bromotyrosine and 3-chlorotyrosine concentrations in asthmatic patients: lack of increase in 3-bromotyrosine concentration in urine and plasma proteins in aspirin-induced asthma after intravenous aspirin challenge. Clinical and experimental allergy : journal of the British Society for Allergy and Clinical Immunology 20040601
Kinetic analysis of the reactions of hypobromous acid with protein components: implications for cellular damage and use of 3-bromotyrosine as a marker of oxidative stress. Biochemistry 20040427
Artifact-free quantification of free 3-chlorotyrosine, 3-bromotyrosine, and 3-nitrotyrosine in human plasma by electron capture-negative chemical ionization gas chromatography mass spectrometry and liquid chromatography-electrospray ionization tandem mass spectrometry. Analytical biochemistry 20020115
Eosinophils are a major source of nitric oxide-derived oxidants in severe asthma: characterization of pathways available to eosinophils for generating reactive nitrogen species. Journal of immunology (Baltimore, Md. : 1950) 20010501
Properties