Cas no 135733-32-3 (3-Hydroxymethyl-4-phenyl-1,2,5-oxadiazole)
135733-32-3 structure
Product Name:3-Hydroxymethyl-4-phenyl-1,2,5-oxadiazole
CAS No:135733-32-3
MF:C9H8N2O2
MW:176.172021865845
CID:2916442
Update Time:2023-08-10
3-Hydroxymethyl-4-phenyl-1,2,5-oxadiazole Chemical and Physical Properties
Names and Identifiers
-
- 3-hydroxymethyl-4-phenyl-1,2,5-oxadiazole
- Furazanmethanol, phenyl-
- 4-Phenyl-1,2,5-oxadiazole-3-methanol
- 3-Hydroxymethyl-4-phenyl-1,2,5-oxadiazole
-
- Inchi： 1S/C9H8N2O2/c12-6-8-9(11-13-10-8)7-4-2-1-3-5-7/h1-5,12H,6H2
- InChI Key： LOVBVRLCHLMQIZ-UHFFFAOYSA-N
- SMILES： O1N=C(CO)C(C2C=CC=CC=2)=N1
Computed Properties
- Hydrogen Bond Donor Count: 1
- Hydrogen Bond Acceptor Count: 4
- Heavy Atom Count: 13
- Rotatable Bond Count: 2
- Complexity: 160
- XLogP3: 1.3
- Topological Polar Surface Area: 59.2
3-Hydroxymethyl-4-phenyl-1,2,5-oxadiazole Related Literature
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Helga Garcia,Rui Ferreira,Marija Petkovic,Jamie L. Ferguson,Maria C. Leit?o,H. Q. Nimal Gunaratne,Luís Paulo N. Rebelo Green Chem., 2010,12, 367-369
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Jing Yu,Yu-Qi Lyu,Jiapeng Liu,Mohammed B. Effat,Junxiong Wu J. Mater. Chem. A, 2019,7, 17995-18002
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Nan Fu,Naphaporn Chiewchan,Xiao Dong Chen Food Funct., 2020,11, 211-220
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Yi Cao,Yujiao Xiahou,Lixiang Xing,Xiang Zhang,Hong Li,ChenShou Wu,Haibing Xia Nanoscale, 2020,12, 20456-20466
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