Cas no 1374651-55-4 (6-(aminomethyl)-2-methyl-1(2h)-isoquinolinone)
1374651-55-4 structure
Product Name:6-(aminomethyl)-2-methyl-1(2h)-isoquinolinone
CAS No:1374651-55-4
MF:C11H12N2O
MW:188.225782394409
CID:1244863
PubChem ID:115063640
Update Time:2025-04-20
6-(aminomethyl)-2-methyl-1(2h)-isoquinolinone Chemical and Physical Properties
Names and Identifiers
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- 6-(aminomethyl)-2-methyl-1(2h)-isoquinolinone
- 1374651-55-4
- 6-(aminomethyl)-2-methylisoquinolin-1(2H)-one
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- Inchi： 1S/C11H12N2O/c1-13-5-4-9-6-8(7-12)2-3-10(9)11(13)14/h2-6H,7,12H2,1H3
- InChI Key： ZHGQBPNWLDFMGJ-UHFFFAOYSA-N
- SMILES： O=C1C2C=CC(CN)=CC=2C=CN1C
Computed Properties
- Exact Mass: 188.094963011g/mol
- Monoisotopic Mass: 188.094963011g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 1
- Hydrogen Bond Acceptor Count: 2
- Heavy Atom Count: 14
- Rotatable Bond Count: 1
- Complexity: 262
- 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: 0.4
- Topological Polar Surface Area: 46.3?2
6-(aminomethyl)-2-methyl-1(2h)-isoquinolinone Related Literature
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Denis V. Korchagin,Elena A. Yureva,Alexander V. Akimov,Eugenii Ya. Misochko,Gennady V. Shilov,Artem D. Talantsev,Roman B. Morgunov,Alexander A. Shakin,Sergey M. Aldoshin,Boris S. Tsukerblat Dalton Trans., 2017,46, 7540-7548
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Maomao Hou,Fenglin Zhong,Qiu Jin,Enjiang Liu,Jie Feng,Tengyun Wang,Yue Gao RSC Adv., 2017,7, 34392-34400
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Min Kim,Jae-Joon Lee,Tengling Ye,Panagiotis E. Keivanidis,Kilwon Cho J. Mater. Chem. C, 2020,8, 1686-1696
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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
1374651-55-4 (6-(aminomethyl)-2-methyl-1(2h)-isoquinolinone) Related Products
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