Cas no 74632-26-1 (3-Pyridinecarboxylicacid, 1,4-dihydro-5-methyl-4-oxo-)
74632-26-1 structure
Product Name:3-Pyridinecarboxylicacid, 1,4-dihydro-5-methyl-4-oxo-
CAS No:74632-26-1
MF:C7H7NO3
MW:153.135381937027
CID:556955
PubChem ID:4739502
Update Time:2025-04-19
3-Pyridinecarboxylicacid, 1,4-dihydro-5-methyl-4-oxo- Chemical and Physical Properties
Names and Identifiers
-
- 3-Pyridinecarboxylicacid, 1,4-dihydro-5-methyl-4-oxo-
- 3-Pyridinecarboxylicacid,1,4-dihydro-5-methyl-4-oxo-(9CI)
- 5-methyl-4-oxo-1H-pyridine-3-carboxylic acid
- AKOS002665632
- Z1582263000
- 4-Hydroxy-5-methylnicotinicacid
- EN300-119449
- DTXSID30406278
- SCHEMBL9311927
- 74632-26-1
- AKOS022634958
- 4-Hydroxy-5-methylnicotinic acid
- CS-0224448
- AT13143
- 57658-55-6
- 4-hydroxy-5-methylpyridine-3-carboxylic acid
-
- Inchi： 1S/C7H7NO3/c1-4-2-8-3-5(6(4)9)7(10)11/h2-3H,1H3,(H,8,9)(H,10,11)
- InChI Key： GGFJMMODEZOLIY-UHFFFAOYSA-N
- SMILES： O=C1C(C(=O)O)=CNC=C1C
Computed Properties
- Exact Mass: 153.042593085g/mol
- Monoisotopic Mass: 153.042593085g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 2
- Hydrogen Bond Acceptor Count: 4
- Heavy Atom Count: 11
- Rotatable Bond Count: 1
- Complexity: 275
- 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: 66.4?2
3-Pyridinecarboxylicacid, 1,4-dihydro-5-methyl-4-oxo- Related Literature
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Domenico Lombardo,Gianmarco Munaò,Pietro Calandra,Luigi Pasqua,Maria Teresa Caccamo Phys. Chem. Chem. Phys., 2019,21, 11983-11991
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Shintaro Takata,Yoshihiro Miura Phys. Chem. Chem. Phys., 2014,16, 24784-24789
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Qiao Song,Angela Bamesberger,Lingyun Yang,Haley Houtwed,Haishi Cao Analyst, 2014,139, 3588-3592
74632-26-1 (3-Pyridinecarboxylicacid, 1,4-dihydro-5-methyl-4-oxo-) Related Products
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