Cas no 79781-46-7 (2,3-Naphthalenedicarbonitrile, 1-methoxy-4-phenyl-)
79781-46-7 structure
Product Name:2,3-Naphthalenedicarbonitrile, 1-methoxy-4-phenyl-
CAS No:79781-46-7
MF:C19H12N2O
MW:284.31138420105
CID:1798714
PubChem ID:12713690
Update Time:2025-04-21
2,3-Naphthalenedicarbonitrile, 1-methoxy-4-phenyl- Chemical and Physical Properties
Names and Identifiers
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- 2,3-Naphthalenedicarbonitrile, 1-methoxy-4-phenyl-
- 1-methoxy-4-phenylnaphthalene-2,3-dicarbonitrile
- DTXSID50507731
- 79781-46-7
-
- Inchi： 1S/C19H12N2O/c1-22-19-15-10-6-5-9-14(15)18(13-7-3-2-4-8-13)16(11-20)17(19)12-21/h2-10H,1H3
- InChI Key： VLKMSCNPIPAWJM-UHFFFAOYSA-N
- SMILES： O(C)C1C(C#N)=C(C#N)C(C2C=CC=CC=2)=C2C=CC=CC2=1
Computed Properties
- Exact Mass: 284.094963011g/mol
- Monoisotopic Mass: 284.094963011g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 0
- Hydrogen Bond Acceptor Count: 3
- Heavy Atom Count: 22
- Rotatable Bond Count: 2
- Complexity: 478
- 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: 4.2
- Topological Polar Surface Area: 56.8?2
2,3-Naphthalenedicarbonitrile, 1-methoxy-4-phenyl- Related Literature
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Hyejin Moon,Aaron R. Wheeler,Robin L. Garrell,Chang-Jin “CJ” Kim Lab Chip, 2006,6, 1213-1219
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Jialiang Yuan,Ran Dong,Yuan Li,Yang Liu,Zhuo Zheng,Yuxia Liu,Yan Sun,Benhe Zhong,Zhenguo Wu,Xiaodong Guo Chem. Commun., 2021,57, 13004-13007
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R. M. Pemberton,J. P. Hart,T. T. Mottram Analyst, 2001,126, 1866-1871
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5. An all-solid-state imprinted polymer-based potentiometric sensor for determination of bisphenol S?Rongning Liang,Tanji Yin,Ruiqing Yao,Wei Qin RSC Adv., 2016,6, 73308-73312
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