Cas no 89159-34-2 (6-methyl-1H-pyrrolo[3,4-c]pyridine-3,4(2H,5H)-dione)
![6-methyl-1H-pyrrolo[3,4-c]pyridine-3,4(2H,5H)-dione structure](https://ossimg.kuujia.com/scimg/89500/89159-34-2x500.png)
89159-34-2 structure
Product Name:6-methyl-1H-pyrrolo[3,4-c]pyridine-3,4(2H,5H)-dione
CAS No:89159-34-2
MF:C8H8N2O2
MW:164.161321640015
CID:610061
PubChem ID:596283
Update Time:2025-04-19
6-methyl-1H-pyrrolo[3,4-c]pyridine-3,4(2H,5H)-dione Chemical and Physical Properties
Names and Identifiers
-
- 6-methyl-1H-pyrrolo[3,4-c]pyridine-3,4(2H,5H)-dione
- 1H-Pyrrolo[3,4-c]pyridine-3,4(2H,5H)-dione, 6-methyl-
- 6-methyl-2,5-dihydro-1H-pyrrolo[3,4-c]pyridine-3,4-dione
- QKHQTKXYVUEONP-UHFFFAOYSA-
- AKOS037623693
- QKHQTKXYVUEONP-UHFFFAOYSA-N
- DTXSID00344370
- InChI=1/C8H8N2O2/c1-4-2-5-3-9-7(11)6(5)8(12)10-4/h2H,3H2,1H3,(H,9,11)(H,10,12)
- AKOS001717574
- 6-Methyl-1,2-dihydro-3H-pyrrolo[3,4-c]pyridine-3,4(5H)-dione
- CBDivE_000702
- 89159-34-2
-
- Inchi： 1S/C8H8N2O2/c1-4-2-5-3-9-7(11)6(5)8(12)10-4/h2H,3H2,1H3,(H,9,11)(H,10,12)
- InChI Key： QKHQTKXYVUEONP-UHFFFAOYSA-N
- SMILES： O=C1C2C(NC(C)=CC=2CN1)=O
Computed Properties
- Exact Mass: 164.058577502g/mol
- Monoisotopic Mass: 164.058577502g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 2
- Hydrogen Bond Acceptor Count: 2
- Heavy Atom Count: 12
- Rotatable Bond Count: 0
- Complexity: 339
- 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: -0.8
- Topological Polar Surface Area: 58.2?2
6-methyl-1H-pyrrolo[3,4-c]pyridine-3,4(2H,5H)-dione Related Literature
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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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Gaurav J. Shah,Eric P.-Y. Chiou,Ming C. Wu,Chang-Jin “CJ” Kim Lab Chip, 2009,9, 1732-1739
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J. Zagora,M. Vosla?,L. Schreiberová,I. Schreiber Phys. Chem. Chem. Phys., 2002,4, 1284-1291
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Eric Besson,Stéphane Gastaldi,Emily Bloch,Selma Aslan,Hakim Karoui,Olivier Ouari,Micael Hardy Analyst, 2019,144, 4194-4203
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