Cas no 119646-49-0 (3-Pyridinecarboxamide,6-(hydroxymethyl)-)
119646-49-0 structure
Product Name:3-Pyridinecarboxamide,6-(hydroxymethyl)-
CAS No:119646-49-0
MF:C7H8N2O2
MW:152.150621414185
CID:137455
PubChem ID:45084333
Update Time:2025-04-19
3-Pyridinecarboxamide,6-(hydroxymethyl)- Chemical and Physical Properties
Names and Identifiers
-
- 3-Pyridinecarboxamide,6-(hydroxymethyl)-
- 3-Pyridinecarboxamide, 6-(hydroxymethyl)
- 3-Pyridinecarboxamide,6-(hydroxymethyl)-(9CI)
- 6-(hydroxymethyl)-3-Pyridinecarboxamide
- 6-(hydroxymethyl)pyridine-3-carboxamide
- 6-Hydroxymethyl-nicotinamide
- SCHEMBL2937228
- MFCD11656601
- SY319363
- AKOS015910991
- DTXSID00665592
- 6-(hydroxymethyl)nicotinamide
- 119646-49-0
- F86765
- WJDRYPLEVGPPCO-UHFFFAOYSA-N
-
- Inchi： 1S/C7H8N2O2/c8-7(11)5-1-2-6(4-10)9-3-5/h1-3,10H,4H2,(H2,8,11)
- InChI Key： WJDRYPLEVGPPCO-UHFFFAOYSA-N
- SMILES： OCC1C=CC(C(N)=O)=CN=1
Computed Properties
- Exact Mass: 152.059
- Monoisotopic Mass: 152.059
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 2
- Hydrogen Bond Acceptor Count: 3
- Heavy Atom Count: 11
- Rotatable Bond Count: 2
- Complexity: 149
- 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
- Topological Polar Surface Area: 76.2A^2
- XLogP3: -1.1
Experimental Properties
- PSA: 77.20000
- LogP: 0.55700
3-Pyridinecarboxamide,6-(hydroxymethyl)- Related Literature
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Priyambada Nayak,Tanmaya Badapanda,Anil Kumar Singh,Simanchalo Panigrahi RSC Adv., 2017,7, 16319-16331
-
Siquan Zhang,Shengyao Wang,Liping Guo,Hao Chen,Bien Tan,Shangbin Jin J. Mater. Chem. C, 2020,8, 192-200
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Bidyut Kumar Kundu,Rinky Singh,Ritudhwaj Tiwari,Debasis Nayak New J. Chem., 2019,43, 4867-4877
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Hamid Heydari,Mohammad B. Gholivand New J. Chem., 2017,41, 237-244
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