Cas no 888967-50-8 (3-Pyridinecarbonitrile, 6-[3-(hydroxymethyl)phenoxy]-)
![3-Pyridinecarbonitrile, 6-[3-(hydroxymethyl)phenoxy]- structure](https://ossimg.kuujia.com/scimg/889000/888967-50-8x500.png)
888967-50-8 structure
Product Name:3-Pyridinecarbonitrile, 6-[3-(hydroxymethyl)phenoxy]-
CAS No:888967-50-8
MF:C13H10N2O2
MW:226.230702877045
CID:1934192
PubChem ID:61679694
Update Time:2025-04-21
3-Pyridinecarbonitrile, 6-[3-(hydroxymethyl)phenoxy]- Chemical and Physical Properties
Names and Identifiers
-
- 3-Pyridinecarbonitrile, 6-[3-(hydroxymethyl)phenoxy]-
- SCHEMBL3172303
- DB-399082
- 888967-50-8
- AKOS010945675
- 6-[3-(Hydroxymethyl)phenoxy]-3-pyridinecarbonitrile
- 6-(3-hydroxymethyl-phenoxy)-nicotinonitrile
- MYDHRVUZZPOITB-UHFFFAOYSA-N
-
- Inchi： 1S/C13H10N2O2/c14-7-11-4-5-13(15-8-11)17-12-3-1-2-10(6-12)9-16/h1-6,8,16H,9H2
- InChI Key： MYDHRVUZZPOITB-UHFFFAOYSA-N
- SMILES： O(C1C=CC(C#N)=CN=1)C1=CC=CC(CO)=C1
Computed Properties
- Exact Mass: 226.074227566Da
- Monoisotopic Mass: 226.074227566Da
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 1
- Hydrogen Bond Acceptor Count: 4
- Heavy Atom Count: 17
- Rotatable Bond Count: 3
- Complexity: 286
- 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: 1.5
- Topological Polar Surface Area: 66.1?2
3-Pyridinecarbonitrile, 6-[3-(hydroxymethyl)phenoxy]- Related Literature
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Huabin Zhang,Shaowu Du CrystEngComm, 2014,16, 4059-4068
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Kanjun Sun,Fengting Hua,Shuzhen Cui,Yanrong Zhu,Hui Peng,Guofu Ma RSC Adv., 2021,11, 37631-37642
-
Karl Crowley,Eimer O'Malley,Aoife Morrin,Malcolm R. Smyth,Anthony J. Killard Analyst, 2008,133, 391-399
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Marta Liras,Isabel Quijada-Garrido,Marta Palacios-Cuesta,Sonia Mu?oz-Durieux,Olga García Polym. Chem., 2014,5, 433-442
888967-50-8 (3-Pyridinecarbonitrile, 6-[3-(hydroxymethyl)phenoxy]-) Related Products
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