Cas no 507476-72-4 (1-Naphthalenecarbonitrile, 4-(1-piperidinyl)-)
507476-72-4 structure
Product Name:1-Naphthalenecarbonitrile, 4-(1-piperidinyl)-
CAS No:507476-72-4
MF:C16H16N2
MW:236.311643600464
CID:364118
PubChem ID:11665856
Update Time:2025-04-19
1-Naphthalenecarbonitrile, 4-(1-piperidinyl)- Chemical and Physical Properties
Names and Identifiers
-
- 1-Naphthalenecarbonitrile, 4-(1-piperidinyl)-
- 4-piperidin-1-ylnaphthalene-1-carbonitrile
- DTXSID50470274
- 507476-72-4
- 4-(PIPERIDIN-1-YL)NAPHTHALENE-1-CARBONITRILE
- SCHEMBL3606687
- 4-(1-piperidinyl)-1-naphthonitrile
- 4-(Piperidin-1-yl)-1-naphthonitrile
-
- Inchi： 1S/C16H16N2/c17-12-13-8-9-16(18-10-4-1-5-11-18)15-7-3-2-6-14(13)15/h2-3,6-9H,1,4-5,10-11H2
- InChI Key： RKRIJSUSKWFLIC-UHFFFAOYSA-N
- SMILES： N1(C2=CC=C(C#N)C3C=CC=CC2=3)CCCCC1
Computed Properties
- Exact Mass: 236.13148
- Monoisotopic Mass: 236.131348519g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 0
- Hydrogen Bond Acceptor Count: 2
- Heavy Atom Count: 18
- Rotatable Bond Count: 1
- Complexity: 323
- 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: 3.9
- Topological Polar Surface Area: 27?2
Experimental Properties
- PSA: 27.03
1-Naphthalenecarbonitrile, 4-(1-piperidinyl)- Related Literature
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Jason Wan Lab Chip, 2020,20, 4528-4538
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Xiaotong Feng,Lei Bian,Jie Ma,Lei Zhou,Xiayan Wang,Guangsheng Guo,Qiaosheng Pu Chem. Commun., 2019,55, 3963-3966
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Christopher J. Harrison,Kyle J. Berean,Enrico Della Gaspera,Jian Zhen Ou,Richard B. Kaner,Kourosh Kalantar-zadeh,Torben Daeneke Nanoscale, 2016,8, 16276-16283
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Jason Y. C. Lim,Yong Yu,Guorui Jin,Kai Li,Yi Lu,Jianping Xie Nanoscale Adv., 2020,2, 3921-3932
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Kay S. McMillan,Anthony G. McCluskey,Annette Sorensen,Marie Boyd,Michele Zagnoni Analyst, 2016,141, 100-110
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