Cas no 920036-18-6 (1,3-Benzenedicarbonitrile, 5-(3-chloro-5-methoxyphenoxy)-)
920036-18-6 structure
Product Name:1,3-Benzenedicarbonitrile, 5-(3-chloro-5-methoxyphenoxy)-
CAS No:920036-18-6
MF:C15H9ClN2O2
MW:284.697162389755
CID:759083
PubChem ID:70842935
Update Time:2025-04-19
1,3-Benzenedicarbonitrile, 5-(3-chloro-5-methoxyphenoxy)- Chemical and Physical Properties
Names and Identifiers
-
- 1,3-Benzenedicarbonitrile, 5-(3-chloro-5-methoxyphenoxy)-
- 5-(3-chloro-5-methoxyphenoxy)benzene-1,3-dicarbonitrile
- 920036-18-6
- DTXSID10744044
- SCHEMBL13140960
-
- Inchi： 1S/C15H9ClN2O2/c1-19-13-5-12(16)6-15(7-13)20-14-3-10(8-17)2-11(4-14)9-18/h2-7H,1H3
- InChI Key： AUIBDDBLGIHZLO-UHFFFAOYSA-N
- SMILES： ClC1C=C(C=C(C=1)OC1C=C(C#N)C=C(C#N)C=1)OC
Computed Properties
- Exact Mass: 284.0352552g/mol
- Monoisotopic Mass: 284.0352552g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 0
- Hydrogen Bond Acceptor Count: 4
- Heavy Atom Count: 20
- Rotatable Bond Count: 3
- Complexity: 400
- 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: 66?2
1,3-Benzenedicarbonitrile, 5-(3-chloro-5-methoxyphenoxy)- Related Literature
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J. Zagora,M. Vosla?,L. Schreiberová,I. Schreiber Phys. Chem. Chem. Phys., 2002,4, 1284-1291
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Dan Yang,Yanping Zhou,Xianhong Rui,Jixin Zhu,Ziyang Lu,Eileen Fong,Qingyu Yan RSC Adv., 2013,3, 14960-14962
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Zhiyan Chen,Nan Wu,Yaobing Wang,Bing Wang,Yingde Wang J. Mater. Chem. A, 2018,6, 516-526
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Chen Long,Ying Dai,Jianwei Li,Hao Jin Nanoscale, 2020,12, 21124-21130
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Alena Koukalová,?árka Pokorná,Aimee L. Boyle,Nestor Lopez Mora,Alexander Kros,Martin Hof,Radek ?achl Nanoscale, 2018,10, 19064-19073
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