Cas no 1492-54-2 (Benzo[h]phenaleno[1,9-bc]acridine,7-methyl- (7CI,8CI,9CI))
1492-54-2 structure
Product Name:Benzo[h]phenaleno[1,9-bc]acridine,7-methyl- (7CI,8CI,9CI)
Benzo[h]phenaleno[1,9-bc]acridine,7-methyl- (7CI,8CI,9CI) Chemical and Physical Properties
Names and Identifiers
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- Benzo[h]phenaleno[1,9-bc]acridine,7-methyl- (7CI,8CI,9CI)
- 7-Methylbenzo[h]phenaleno[1,9-bc]acridine
- 7-Methyl-benzo<a>phenaleno<1,9-ij>acridin
- DTXSID80164194
- 1492-54-2
- 7-Methylbenzo(h)phenaleno(1,9-bc)acridine
- 14-methyl-3-azaheptacyclo[18.6.2.02,15.04,13.05,10.017,27.024,28]octacosa-1(27),2(15),3,5,7,9,11,13,16,18,20(28),21,23,25-tetradecaene
- BENZO(h)PHENALENO(1,9-bc)ACRIDINE, 7-METHYL-
- BRN 1437747
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- Inchi: 1S/C28H17N/c1-16-21-13-11-17-5-2-3-8-22(17)27(21)29-28-23-14-12-19-7-4-6-18-9-10-20(15-24(16)28)26(23)25(18)19/h2-15H,1H3
- InChI Key: NNOQBQNHYWIEBO-UHFFFAOYSA-N
- SMILES: N1C2C3C=CC=CC=3C=CC=2C(C)=C2C=C3C=CC4=CC=CC5C=CC(C=12)=C3C=54
Computed Properties
- Exact Mass: 367.13621
- Monoisotopic Mass: 367.1361
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 0
- Hydrogen Bond Acceptor Count: 1
- Heavy Atom Count: 29
- Rotatable Bond Count: 0
- Complexity: 628
- 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
- Topological Polar Surface Area: 12.9
- XLogP3: 8.3
Experimental Properties
- Density: 1.2679 (rough estimate)
- Boiling Point: 487.99°C (rough estimate)
- Flash Point: 285.3°C
- Refractive Index: 1.9470 (estimate)
- PSA: 12.89
Benzo[h]phenaleno[1,9-bc]acridine,7-methyl- (7CI,8CI,9CI) Related Literature
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Chung-Sung Yang,Mong-Shian Shih,Fang-Yi Chang New J. Chem., 2006,30, 729-735
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Guiying Zhang,Maosheng Cheng,Yanni Li,Keliang Liu,Lifeng Cai Chem. Commun., 2013,49, 11086-11088
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Ziyang Deng,Changwei Chen,Sunliang Cui RSC Adv., 2016,6, 93753-93755
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J. Matthew Kurley,Phillip W. Halstenberg,Abbey McAlister,Stephen Raiman,Richard T. Mayes RSC Adv., 2019,9, 25602-25608
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Craig A. Kelly,David R. Rosseinsky Phys. Chem. Chem. Phys., 2001,3, 2086-2090
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