Cas no 802906-31-6 (2-Quinolinecarboxaldehyde,4-methoxy-6,8-dimethyl-(9CI))
802906-31-6 structure
Product Name:2-Quinolinecarboxaldehyde,4-methoxy-6,8-dimethyl-(9CI)
CAS No:802906-31-6
MF:C13H13NO2
MW:215.247823476791
CID:714022
PubChem ID:45097420
Update Time:2025-04-19
2-Quinolinecarboxaldehyde,4-methoxy-6,8-dimethyl-(9CI) Chemical and Physical Properties
Names and Identifiers
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- 2-Quinolinecarboxaldehyde,4-methoxy-6,8-dimethyl-(9CI)
- 802906-31-6
- 4-Methoxy-6,8-dimethylquinoline-2-carbaldehyde
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- Inchi： 1S/C13H13NO2/c1-8-4-9(2)13-11(5-8)12(16-3)6-10(7-15)14-13/h4-7H,1-3H3
- InChI Key： VOBIACZYDMTLNU-UHFFFAOYSA-N
- SMILES： O(C)C1C=C(C=O)N=C2C(C)=CC(C)=CC2=1
Computed Properties
- Exact Mass: 215.095
- Monoisotopic Mass: 215.095
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 0
- Hydrogen Bond Acceptor Count: 3
- Heavy Atom Count: 16
- Rotatable Bond Count: 2
- Complexity: 256
- 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
- Topological Polar Surface Area: 39.2A^2
- XLogP3: 2.7
2-Quinolinecarboxaldehyde,4-methoxy-6,8-dimethyl-(9CI) Related Literature
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1. 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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Yang Chen,Di Zhou,Zheyi Meng,Jin Zhai Chem. Commun., 2016,52, 10020-10023
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Li-Hua Gan,Rui Wu,Jian-Lei Tian,Patrick W. Fowler Phys. Chem. Chem. Phys., 2017,19, 419-425
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Xin Fu,Qing-rong Liang,Rong-guang Luo,Yan-shu Li,Xiao-ping Xiao,Lu-lu Yu,Wen-zhe Shan,Guang-qin Fan J. Mater. Chem. B, 2019,7, 3088-3099
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Jingquan Liu,Huiyun Liu,Zhongfan Jia,Volga Bulmus,Thomas P. Davis Chem. Commun., 2008, 6582-6584
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