1-Aminofluorene - CAS 6344-63-4
Catalog: |
BB032150 |
Product Name: |
1-Aminofluorene |
CAS: |
6344-63-4 |
Synonyms: |
9H-fluoren-1-amine |
IUPAC Name: | 9H-fluoren-1-amine |
Description: | 1-Aminofluorene (CAS# 6344-63-4) is an intermediate used in the synthesis of Fluoren-1-ol (F462450), which is a metabolite of the PAH micropollutant Fluorene (F462002) with potential mutagenic effects. It is used as biomarkers to evaluate exposure to PAHs and environmental tobacco smoke in general population. Photoluminescent dye. |
Molecular Weight: | 181.23 |
Molecular Formula: | C13H11N |
Canonical SMILES: | C1C2=CC=CC=C2C3=C1C(=CC=C3)N |
InChI: | InChI=1S/C13H11N/c14-13-7-3-6-11-10-5-2-1-4-9(10)8-12(11)13/h1-7H,8,14H2 |
InChI Key: | CYSPWCARDHRYJX-UHFFFAOYSA-N |
Boiling Point: | 358.3 °C at 760 mmHg |
Density: | 1.203 g/cm3 |
MDL: | MFCD00010780 |
LogP: | 3.42120 |
GHS Hazard Statement: | H302 (100%): Harmful if swallowed [Warning Acute toxicity, oral] |
Precautionary Statement: | P261, P264, P270, P271, P280, P301+P312, P302+P352, P304+P312, P304+P340, P305+P351+P338, P312, P321, P322, P330, P332+P313, P337+P313, P362, P363, P403+P233, P405, and P501 |
Signal Word: | Warning |
Publication Number | Title | Priority Date |
WO-2021059086-A1 | Organic compound, optical device, light emitting device, light emitting apparatus, electronic device, and lighting device | 20190927 |
WO-2021020462-A1 | Intracellular delivery peptide | 20190729 |
WO-2020127145-A2 | Materials for electronic devices | 20181220 |
WO-2020127259-A2 | Materials for electronic devices | 20181220 |
WO-2020064004-A1 | Mdm2 inhibitor, preparation method therefor, pharmaceutical composition thereof, and use thereof | 20180930 |
PMID | Publication Date | Title | Journal |
22324853 | 20120306 | Sequence effects on translesion synthesis of an aminofluorene-DNA adduct: conformational, thermodynamic, and primer extension kinetic studies | Biochemistry |
21410284 | 20110418 | Conformational and thermodynamic impact of bulky aminofluorene adduction on simulated translesion DNA synthesis | Chemical research in toxicology |
20116221 | 20110301 | Antimutagenicity mechanisms of the Rhoeo discolor ethanolic extract | Experimental and toxicologic pathology : official journal of the Gesellschaft fur Toxikologische Pathologie |
18524623 | 20080801 | 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 |
18613294 | 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 |
Complexity: | 213 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 181.089149355 |
Formal Charge: | 0 |
Heavy Atom Count: | 14 |
Hydrogen Bond Acceptor Count: | 1 |
Hydrogen Bond Donor Count: | 1 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 181.089149355 |
Rotatable Bond Count: | 0 |
Topological Polar Surface Area: | 26 Å2 |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | 3.2 |
Online Inquiry
Customer Support
Customer Centered
Related Functional Groups
Nitrogen Compounds
Customers Also Viewed
INDUSTRY LEADERS TRUST OUR PRODUCTS