HIT ID: HIT212687398
Cas No: 78876-52-5
分子式: C13H9ClOS
分子量: 248.72
常用名: 1-Chloro-6-(5-(prop-1-ynyl)thiophen-2-yl)hexa-3,5-diyn-2-ol
常用名: 1-Chloro-6-(5-(prop-1-ynyl)thiophen-2-yl)hexa-3,5-diyn-2-ol
氢键受体数 (HBA): 1
氢键供体数 (HBD): 1
LogP: 3.910427
IUPAC: 1-chloro-6-[5-(prop-1-yn-1-yl)thiophen-2-yl]hexa-3,5-diyn-2-ol
IUPAC: 1-chloro-6-[5-(prop-1-yn-1-yl)thiophen-2-yl]hexa-3,5-diyn-2-ol
SMILES: CC#Cc1ccc(s1)C#CC#CC(O)CCl
SMILES: CC#Cc1ccc(s1)C#CC#CC(O)CCl
InChI key: OPRUYGQNFDVQFL-UHFFFAOYSA-N
