Home Other Building Blocks 9H-FLUOREN-9-AMINE

9H-FLUOREN-9-AMINE

CAS No.:
525-03-1
Catalog Number:
AG00DE4Y
Molecular Formula:
C13H11N
Molecular Weight:
181.2331
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Product Description
Catalog Number:
AG00DE4Y
Chemical Name:
9H-FLUOREN-9-AMINE
CAS Number:
525-03-1
Molecular Formula:
C13H11N
Molecular Weight:
181.2331
MDL Number:
MFCD00871339
IUPAC Name:
9H-fluoren-9-amine
InChI:
InChI=1S/C13H11N/c14-13-11-7-3-1-5-9(11)10-6-2-4-8-12(10)13/h1-8,13H,14H2
InChI Key:
OUGMRQJTULXVDC-UHFFFAOYSA-N
SMILES:
NC1c2ccccc2c2c1cccc2
UNII:
4NHO2K4K5B
Properties
Complexity:
191  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
181.089g/mol
Formal Charge:
0
Heavy Atom Count:
14  
Hydrogen Bond Acceptor Count:
1  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
181.238g/mol
Monoisotopic Mass:
181.089g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
26A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.2  
Literature
Title Journal
Sequence effects on translesion synthesis of an aminofluorene-DNA adduct: conformational, thermodynamic, and primer extension kinetic studies. Biochemistry 20120306
Bypass of aflatoxin B1 adducts by the Sulfolobus solfataricus DNA polymerase IV. Journal of the American Chemical Society 20110817
γ-Hydroxy-1,N2-propano-2'-deoxyguanosine DNA adduct conjugates the N-terminal amine of the KWKK peptide via a carbinolamine linkage. Chemical research in toxicology 20110718
Linear free energy relationships predict coordination and π-stacking interactions of small molecules with ferriprotoporphyrin IX. Journal of inorganic biochemistry 20110501
Conformational and thermodynamic impact of bulky aminofluorene adduction on simulated translesion DNA synthesis. Chemical research in toxicology 20110418
Antimutagenicity mechanisms of the Rhoeo discolor ethanolic extract. Experimental and toxicologic pathology : official journal of the Gesellschaft fur Toxikologische Pathologie 20110301
Synthesis and SAR studies of 1,4-benzoxazine MenB inhibitors: novel antibacterial agents against Mycobacterium tuberculosis. Bioorganic & medicinal chemistry letters 20101101
Sequence verification of oligonucleotides containing multiple arylamine modifications by enzymatic digestion and liquid chromatography mass spectrometry (LC/MS). Journal of the American Society for Mass Spectrometry 20080801
High-throughput approaches towards the definitive identification of pharmaceutical drug metabolites. 1. Evidence for an ortho effect on the fragmentation of 4-benzenesulfinyl-3-methylphenylamine using electrospray ionisation mass spectrometry. Rapid communications in mass spectrometry : RCM 20080801
Probing the thermodynamics of aminofluorene-induced translesion DNA synthesis by differential scanning calorimetry. Journal of the American Chemical Society 20071010
Examination of the long-range effects of aminofluorene-induced conformational heterogeneity and its relevance to the mechanism of translesional DNA synthesis. Journal of molecular biology 20070309
Solvent effects on the reactivity of fluorenyl nitrenium ion with DNA-like probes. Biophysical chemistry 20060201
Comparisons of thresholds for carcinogenicity on linear and logarithmic dosage scales. Human & experimental toxicology 20050601
N-oxidation of aromatic amines by intracellular oxidases. Drug metabolism reviews 20020801
Evidence for long-range glycosyl transfer reactions in the gas phase. Journal of the American Society for Mass Spectrometry 20020401
MALDI-FTMS characterization of oligosaccharides labeled with 9-aminofluorene. Journal of the American Society for Mass Spectrometry 20011201
Effects of the butylated hydroxyanisole and butylated hydroxytoluene on the DNA adduct formation and arylamines N-acetyltransferase activity in human colon tumor cells. Anticancer research 20010101
Properties