Cas no 23832-77-1 (3-methoxy-1-methyl-Isoquinoline)
23832-77-1 structure
Product Name:3-methoxy-1-methyl-Isoquinoline
CAS No:23832-77-1
MF:C11H11NO
MW:173.211142778397
CID:1109570
PubChem ID:13479775
Update Time:2025-04-20
3-methoxy-1-methyl-Isoquinoline Chemical and Physical Properties
Names and Identifiers
-
- 3-methoxy-1-methyl-Isoquinoline
- 3-methoxy-1-methylisoquinoline
- SCHEMBL637337
- 23832-77-1
-
- Inchi: 1S/C11H11NO/c1-8-10-6-4-3-5-9(10)7-11(12-8)13-2/h3-7H,1-2H3
- InChI Key: OYRHPGPBJOZXOW-UHFFFAOYSA-N
- SMILES: O(C)C1=CC2C=CC=CC=2C(C)=N1
Computed Properties
- Exact Mass: 173.08413
- Monoisotopic Mass: 173.084063974g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 0
- Hydrogen Bond Acceptor Count: 2
- Heavy Atom Count: 13
- Rotatable Bond Count: 1
- Complexity: 172
- 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: 2.8
- Topological Polar Surface Area: 22.1?2
Experimental Properties
- PSA: 22.12
3-methoxy-1-methyl-Isoquinoline Related Literature
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Priyambada Nayak,Tanmaya Badapanda,Anil Kumar Singh,Simanchalo Panigrahi RSC Adv., 2017,7, 16319-16331
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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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Adeline Huiling Loo,Alessandra Bonanni,Martin Pumera Analyst, 2013,138, 467-471
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Chengbin Yang,Hing Lun Tsang,Pui Man Lau,Ken-Tye Yong,Ho Pui Ho,Siu Kai Kong Analyst, 2017,142, 3579-3587
23832-77-1 (3-methoxy-1-methyl-Isoquinoline) Related Products
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- 2098070-20-1(2-(3-(Pyridin-3-yl)-1H-pyrazol-1-yl)acetimidamide)
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- 89640-58-4(2-Iodo-4-nitrophenylhydrazine)
- 1449132-38-0(3-Fluoro-5-(2-fluoro-5-methylbenzylcarbamoyl)benzeneboronic acid)
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