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halocarban

CAS No.:
369-77-7
Catalog Number:
AG00C7TL
Molecular Formula:
C14H9Cl2F3N2O
Molecular Weight:
349.1353
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Product Description
Catalog Number:
AG00C7TL
Chemical Name:
halocarban
CAS Number:
369-77-7
Molecular Formula:
C14H9Cl2F3N2O
Molecular Weight:
349.1353
MDL Number:
MFCD00867294
IUPAC Name:
1-(4-chlorophenyl)-3-[4-chloro-3-(trifluoromethyl)phenyl]urea
InChI:
InChI=1S/C14H9Cl2F3N2O/c15-8-1-3-9(4-2-8)20-13(22)21-10-5-6-12(16)11(7-10)14(17,18)19/h1-7H,(H2,20,21,22)
InChI Key:
ZFSXZJXLKAJIGS-UHFFFAOYSA-N
SMILES:
O=C(Nc1ccc(c(c1)C(F)(F)F)Cl)Nc1ccc(cc1)Cl
EC Number:
206-724-5
UNII:
I5ZZY3DC5G
NSC Number:
114133
Properties
Complexity:
387  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
348.004g/mol
Formal Charge:
0
Heavy Atom Count:
22  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
2  
Isotope Atom Count:
0
Molecular Weight:
349.134g/mol
Monoisotopic Mass:
348.004g/mol
Rotatable Bond Count:
2  
Topological Polar Surface Area:
41.1A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
5.3  
Literature
Title Journal
An immunoassay to evaluate human/environmental exposure to the antimicrobial triclocarban. Environmental science & technology 20120103
[Observation and study on atmospheric VOCs in Changsha city]. Huan jing ke xue= Huanjing kexue 20111201
The impact of local surface changes in Borneo on atmospheric composition at wider spatial scales: coastal processes, land-use change and air quality. Philosophical transactions of the Royal Society of London. Series B, Biological sciences 20111127
[Comparasion of two methods for recovery of Aeromonas spp. in feces from agar CIN (Cefsulodin-Irgasan-Novobiocin)]. Revista espanola de quimioterapia : publicacion oficial de la Sociedad Espanola de Quimioterapia 20101201
Measuring and modeling of binary mixture effects of pharmaceuticals and nickel on cell viability/cytotoxicity in the human hepatoma derived cell line HepG2. Toxicology and applied pharmacology 20100501
The inducibility of human cytochrome P450 1A by environmental-relevant xenobiotics in the human hepatoma derived cell line HepG2. Environmental toxicology and pharmacology 20091101
Gas chromatography negative ion chemical ionization mass spectrometry: application to the detection of alkyl nitrates and halocarbons in the atmosphere. Journal of chromatography. A 20080801
Aeromonas agar is a useful selective medium for isolating aeromonads from faecal samples. Journal of medical microbiology 20061101
Growth studies of plasmid bearing and plasmid cured Yersinia enterocolitica GER O:3 in the presence of cefsulodin, irgasan and novobiocin at 25 and 37 degrees C. Journal of applied microbiology 20060601
Rapid urease screening of Yersinia on CIN agar plates. International journal of food microbiology 20030715
Inhibition of light emission from the bioluminescent bacterium Vibrio fischeri after exposure to triclosan and related hygiene care products. Luminescence : the journal of biological and chemical luminescence 20010101
Properties