Cas no 24499-89-6 (Benzo[i]thebenidine)
Benzo[i]thebenidine structure
Product Name:Benzo[i]thebenidine
CAS No:24499-89-6
MF:C19H11N
MW:253.297344446182
CID:272556
PubChem ID:290517
Update Time:2025-04-19
Benzo[i]thebenidine Chemical and Physical Properties
Names and Identifiers
-
- Benzo[i]thebenidine
- Dibenzo[j,lmn]phenanthridine
- 12-Azabenzo< a> pyrene
- 4-Azabenzo[a]pyren
- 4-Azabenzo< a> pyren
- AC1L6DXQ
- AC1Q4YQY
- AG-J-99406
- AR-1I3910
- CTK1A4953
- NSC154306
- NSC-154306
- NSC 154306
- Dibenzo(j,lmn)phenanthridine
- 24499-89-6
- DTXSID30302827
-
- Inchi: 1S/C19H11N/c1-2-6-15-13(4-1)10-14-11-20-17-7-3-5-12-8-9-16(15)18(14)19(12)17/h1-11H
- InChI Key: DMCKXSDZCNNPIY-UHFFFAOYSA-N
- SMILES: N1C=C2C=C3C=CC=CC3=C3C=CC4=CC=CC=1C4=C32
Computed Properties
- Exact Mass: 253.08923
- Monoisotopic Mass: 253.089
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 0
- Hydrogen Bond Acceptor Count: 1
- Heavy Atom Count: 20
- Rotatable Bond Count: 0
- Complexity: 378
- Covalently-Bonded Unit Count: 1
- Defined Atom Stereocenter Count: 0
- Undefined Atom Stereocenter Count : 0
- Defined Bond Stereocenter Count: 0
- Undefined Bond Stereocenter Count: 0
- XLogP3: 5
- Topological Polar Surface Area: 12.9?2
Experimental Properties
- Density: 1.337
- Boiling Point: 480.3°C at 760 mmHg
- Flash Point: 216.9°C
- Refractive Index: 1.904
- PSA: 12.89
Benzo[i]thebenidine Related Literature
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Erika A. Cobar,Paul R. Horn,Robert G. Bergman,Martin Head-Gordon Phys. Chem. Chem. Phys., 2012,14, 15328-15339
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Shintaro Takata,Yoshihiro Miura Phys. Chem. Chem. Phys., 2014,16, 24784-24789
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Christopher B. Rodell,Christopher B. Highley,Minna H. Chen,Neville N. Dusaj,Chao Wang,Lin Han,Jason A. Burdick Soft Matter, 2016,12, 7839-7847
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Sowmyalakshmi Venkataraman RSC Adv., 2015,5, 73807-73813
24499-89-6 (Benzo[i]thebenidine) Related Products
- 120-72-9(Indole)
- 6336-32-9(5,11-Dihydroindolo3,2-bcarbazole)
- 230-46-6(1,7-Phenanthroline)
- 2047-89-4(5,6,7,8,9,10-Hexahydrocyclohepta[b]indole)
- 224-42-0(Dibenza,jacridine)
- 230-27-3(7,8-Benzoquinaline)
- 194-59-2(7H-Dibenzoc,gcarbazole)
- 2098070-20-1(2-(3-(Pyridin-3-yl)-1H-pyrazol-1-yl)acetimidamide)
- 2680771-01-9(4-cyclopentyl-3-{(prop-2-en-1-yloxy)carbonylamino}butanoic acid)
- 1444113-98-7(N-(3-cyanothiolan-3-yl)-2-[(2,2,2-trifluoroethyl)sulfanyl]pyridine-4-carboxamide)
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