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Benfluralin

CAS No.:
1861-40-1
Catalog Number:
AG01DB73
Molecular Formula:
C13H16F3N3O4
Molecular Weight:
335.2790
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
50mg
98%
1 week
United States
$154
- +
Product Description
Catalog Number:
AG01DB73
Chemical Name:
Benfluralin
CAS Number:
1861-40-1
Molecular Formula:
C13H16F3N3O4
Molecular Weight:
335.2790
MDL Number:
MFCD11111172
IUPAC Name:
N-butyl-N-ethyl-2,6-dinitro-4-(trifluoromethyl)aniline
InChI:
InChI=1S/C13H16F3N3O4/c1-3-5-6-17(4-2)12-10(18(20)21)7-9(13(14,15)16)8-11(12)19(22)23/h7-8H,3-6H2,1-2H3
InChI Key:
SMDHCQAYESWHAE-UHFFFAOYSA-N
SMILES:
CCCCN(c1c(cc(cc1[N+](=O)[O-])C(F)(F)F)[N+](=O)[O-])CC
EC Number:
217-465-2
UNII:
28224BUY6R
Properties
Complexity:
398  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
335.109g/mol
Formal Charge:
0
Heavy Atom Count:
23  
Hydrogen Bond Acceptor Count:
8  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
335.283g/mol
Monoisotopic Mass:
335.109g/mol
Rotatable Bond Count:
5  
Topological Polar Surface Area:
94.9A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
5.3  
Literature
Title Journal
Dinitroaniline activity in Toxoplasma gondii expressing wild-type or mutant alpha-tubulin. Antimicrobial agents and chemotherapy 20100401
Impact of environmental chemicals on key transcription regulators and correlation to toxicity end points within EPA's ToxCast program. Chemical research in toxicology 20100315
Sharks do get cancer: few surprises in cartilage research. Journal of the National Cancer Institute 20051102
Company ordered to halt sales of unapproved drugs, reimburse buyers. FDA consumer 20040101
Teratogenicity study of some pesticides in chicken embryos. Communications in agricultural and applied biological sciences 20040101
Toxicity and degradation of benefin in chicken embryos. Mededelingen (Rijksuniversiteit te Gent. Fakulteit van de Landbouwkundige en Toegepaste Biologische Wetenschappen) 20020101
Properties