Cas no 101615-77-4 (Pyridinium,3-hydroxy-1-methoxy-, inner salt)
101615-77-4 structure
Product Name:Pyridinium,3-hydroxy-1-methoxy-, inner salt
CAS No:101615-77-4
MF:C6H7NO2
MW:125.125281572342
CID:148474
PubChem ID:145371
Update Time:2025-04-19
Pyridinium,3-hydroxy-1-methoxy-, inner salt Chemical and Physical Properties
Names and Identifiers
-
- Pyridinium,3-hydroxy-1-methoxy-, inner salt
- 1-methoxypyridin-1-ium-3-olate
- 1-methoxy-3-pyridone
- 1-Methoxy-pyridin-3-oxid
- 1-methoxypyridinium-3-olate
- AC1L3R23
- Pyridinium, 3-hydroxy-1-methoxy-, hydroxide, inner salt
- DTXSID70144066
- Pyridinium,3-hydroxy-1-methoxy-,hydroxide,inner salt
- 101615-77-4
-
- Inchi： 1S/C6H7NO2/c1-9-7-4-2-3-6(8)5-7/h2-5H,1H3
- InChI Key： QSIKSVXXOQDQNV-UHFFFAOYSA-N
- SMILES： O(C)[N+]1C=CC=C(C=1)[O-]
Computed Properties
- Exact Mass: 125.04771
- Monoisotopic Mass: 125.048
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 0
- Hydrogen Bond Acceptor Count: 2
- Heavy Atom Count: 9
- Rotatable Bond Count: 1
- Complexity: 87.1
- 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: 1.7
- Topological Polar Surface Area: 36.2?2
Experimental Properties
- PSA: 36.17
- LogP: -0.09330
Pyridinium,3-hydroxy-1-methoxy-, inner salt Related Literature
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Hailing Chen,Lu Yin,Meng Liu,Laibing Wang,Michiya Fujiki,Wei Zhang RSC Adv., 2019,9, 4849-4856
-
Huabin Zhang,Shaowu Du CrystEngComm, 2014,16, 4059-4068
-
Eunhak Lim,Jiyoung Heo,Seong Keun Kim Nanoscale, 2019,11, 11369-11378
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Bidou Wang,Xifeng Chen Analyst, 2014,139, 5695-5699
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Yaqing Liu,Jiangtao Ren,Jing Li,Jiyang Liu,Erkang Wang Chem. Commun., 2012,48, 802-804
101615-77-4 (Pyridinium,3-hydroxy-1-methoxy-, inner salt) Related Products
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- 1444113-98-7(N-(3-cyanothiolan-3-yl)-2-[(2,2,2-trifluoroethyl)sulfanyl]pyridine-4-carboxamide)
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