Cas no 2176-28-5 (6-Phenanthridinecarbonitrile)
6-Phenanthridinecarbonitrile structure
Product Name:6-Phenanthridinecarbonitrile
CAS No:2176-28-5
MF:C14H8N2
MW:204.226722717285
CID:1403832
PubChem ID:609381
Update Time:2025-04-20
6-Phenanthridinecarbonitrile Chemical and Physical Properties
Names and Identifiers
-
- 6-Phenanthridinecarbonitrile
- phenanthridine-6-carbonitrile
- 6-Cyanophenanthridine
- SCHEMBL1993804
- DTXSID00346071
- 2176-28-5
- AMY7521
- VCSHKHPWFRQOOX-UHFFFAOYSA-N
- 6-Phenanthridinecarbonitrile #
-
- Inchi： 1S/C14H8N2/c15-9-14-12-7-2-1-5-10(12)11-6-3-4-8-13(11)16-14/h1-8H
- InChI Key： VCSHKHPWFRQOOX-UHFFFAOYSA-N
- SMILES： N1C(C#N)=C2C=CC=CC2=C2C=CC=CC=12
Computed Properties
- Exact Mass: 204.06884
- Monoisotopic Mass: 204.068748264g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 0
- Hydrogen Bond Acceptor Count: 2
- Heavy Atom Count: 16
- Rotatable Bond Count: 0
- Complexity: 303
- 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: 3.5
- Topological Polar Surface Area: 36.7?2
Experimental Properties
- PSA: 36.68
6-Phenanthridinecarbonitrile Related Literature
-
Hamid Heydari,Mohammad B. Gholivand New J. Chem., 2017,41, 237-244
-
Kui Wu,Zhihua Yang,Shilie Pan Dalton Trans., 2015,44, 19856-19864
-
Kanjun Sun,Fengting Hua,Shuzhen Cui,Yanrong Zhu,Hui Peng,Guofu Ma RSC Adv., 2021,11, 37631-37642
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