Cas no 1261962-14-4 (3-[4-(hydroxymethyl)phenyl]pyridine-4-carboxylic Acid)
1261962-14-4 structure
Product Name:3-[4-(hydroxymethyl)phenyl]pyridine-4-carboxylic Acid
CAS No:1261962-14-4
MF:C13H11NO3
MW:229.231343507767
CID:1223294
PubChem ID:53222755
Update Time:2025-04-20
3-[4-(hydroxymethyl)phenyl]pyridine-4-carboxylic Acid Chemical and Physical Properties
Names and Identifiers
-
- 3-[4-(hydroxymethyl)phenyl]pyridine-4-carboxylic Acid
- 3-(4-(Hydroxymethyl)phenyl)isonicotinic acid
- 3-(4-HYDROXYMETHYLPHENYL)ISONICOTINIC ACID
- 3-(4-(Hydroxymethyl)phenyl)isonicotinicacid
- DTXSID00687113
- MFCD18316937
- 1261962-14-4
-
- MDL: MFCD18316937
- Inchi: 1S/C13H11NO3/c15-8-9-1-3-10(4-2-9)12-7-14-6-5-11(12)13(16)17/h1-7,15H,8H2,(H,16,17)
- InChI Key: RZFUZVWEBAEGAJ-UHFFFAOYSA-N
- SMILES: OCC1C=CC(=CC=1)C1C=NC=CC=1C(=O)O
Computed Properties
- Exact Mass: 229.07389321g/mol
- Monoisotopic Mass: 229.07389321g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 2
- Hydrogen Bond Acceptor Count: 4
- Heavy Atom Count: 17
- Rotatable Bond Count: 3
- Complexity: 261
- 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: 1.1
- Topological Polar Surface Area: 70.4?2
3-[4-(hydroxymethyl)phenyl]pyridine-4-carboxylic Acid Related Literature
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J. Zagora,M. Vosla?,L. Schreiberová,I. Schreiber Phys. Chem. Chem. Phys., 2002,4, 1284-1291
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Partha Laskar,Christine Dufès Nanoscale Adv., 2021,3, 6007-6026
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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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Erika A. Cobar,Paul R. Horn,Robert G. Bergman,Martin Head-Gordon Phys. Chem. Chem. Phys., 2012,14, 15328-15339
1261962-14-4 (3-[4-(hydroxymethyl)phenyl]pyridine-4-carboxylic Acid) Related Products
- 103863-14-5(4-phenylpyridine-3-carboxylic acid)
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- 104096-15-3(3-phenylpyridine-4-carboxylic acid)
- 133362-99-9(2-(PYRIDIN-4-YL)BENZOIC ACID)
- 2098070-20-1(2-(3-(Pyridin-3-yl)-1H-pyrazol-1-yl)acetimidamide)
- 2680771-01-9(4-cyclopentyl-3-{(prop-2-en-1-yloxy)carbonylamino}butanoic acid)
- 1444113-98-7(N-(3-cyanothiolan-3-yl)-2-[(2,2,2-trifluoroethyl)sulfanyl]pyridine-4-carboxamide)
- 332062-08-5(Fmoc-S-3-amino-4,4-diphenyl-butyric acid)
- 1270529-38-8(1,2,3,4,5,6-Hexahydro-[2,3]bipyridinyl-6-ol)
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