Cas no 21064-52-8 ( )
structure
Product Name:
CAS No:21064-52-8
MF:C16H15N
MW:221.297003984451
CID:911047
PubChem ID:268511
Update Time:2025-04-19
Chemical and Physical Properties
Names and Identifiers
-
- 8,9,10,11-tetrahydro-7H-benzo[c]carbazole
- 7,8,9,10-Tetrahydro-3,4-benzo-carbazol
- AC1L6KFA
- AC1Q1IQF
- AG-J-73228
- AR-1H4163
- CTK4E5797
- NSC108765
- MLS002704087
- CHEMBL1720180
- 21064-52-8
- SMR001570794
- DTXSID30296313
- NSC-108765
-
-
- Inchi： 1S/C16H15N/c1-2-6-12-11(5-1)9-10-15-16(12)13-7-3-4-8-14(13)17-15/h1-2,5-6,9-10,17H,3-4,7-8H2
- InChI Key： FBIYLCTWYARPHI-UHFFFAOYSA-N
- SMILES： N1C2C=CC3C=CC=CC=3C=2C2CCCCC1=2
Computed Properties
- Exact Mass: 221.12055
- Monoisotopic Mass: 221.12
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 1
- Hydrogen Bond Acceptor Count: 0
- Heavy Atom Count: 17
- Rotatable Bond Count: 0
- Complexity: 287
- 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: 4.5
- Topological Polar Surface Area: 15.8?2
Experimental Properties
- Density: 1.21
- Boiling Point: 426.6°C at 760 mmHg
- Flash Point: 191.4°C
- Refractive Index: 1.732
- PSA: 15.79
Related Literature
-
Matthew J. Gaunt,Jinquan Yu,Jonathan B. Spencer Chem. Commun., 2001, 1844-1845
-
Max Attwood,Hiroki Akutsu,Lee Martin,Toby J. Blundell,Pierre Le Maguere,Scott S. Turner Dalton Trans., 2021,50, 11843-11851
-
Ji-Ping Wei Nanoscale, 2015,7, 11815-11832
-
Xing Zhao,Lu Bai,Rui-Ying Bao,Zheng-Ying Liu,Ming-Bo Yang,Wei Yang RSC Adv., 2017,7, 46297-46305
-
5. Fatty acid eutectic mixtures and derivatives from non-edible animal fat as phase change materials?Pau Gallart-Sirvent,Marc Martín,Gemma Villorbina,Mercè Balcells,Aran Solé,Luisa F. Cabeza,Ramon Canela-Garayoa RSC Adv., 2017,7, 24133-24139
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