CAS: 875-59-2
名称: 1-(4-hydroxy-2-methylphenyl)ethanone
SMILES:
CC1=C(C=CC(=C1)O)C(=O)C分子加工
分子式
C9H10O2
分子量
150.18
精确质量
150.0681
XLogP
1.9
TPSA
37.3
氢键给体数
1
氢键受体数
2
可旋转键
1
重原子数
11
环数
1
芳香环
1
饱和环
0
脂环
0
立体中心
0
未定义立体
0
形式电荷
0
杂原子数
2
共价单元
1
sp3占比
0.222
摩尔折射率
42.85
补充信息
InChIKey: IAMNVCJECQWBLZ-UHFFFAOYSA-N
同义词
875-59-24'-Hydroxy-2'-methylacetophenone1-(4-Hydroxy-2-methylphenyl)ethanone4-Hydroxy-2-methylacetophenone1-(4-hydroxy-2-methylphenyl)ethan-1-oneEthanone, 1-(4-hydroxy-2-methylphenyl)-2-Methyl-4-hydroxyacetophenone4-Acetyl-3-methylphenol8K85H86ZEDCHEBI:873141-acetyl-4-hydroxy-2-methylbenzeneEINECS 212-874-2NSC-633642'-methyl-4'-hydroxyacetophenoneDTXSID60236363NSC 63364RefChem:523754DTXCID60158854212-874-2InChI=1/C9H10O2/c1-6-5-8(11)3-4-9(6)7(2)10/h3-5,11H,1-2HMFCD000023031-(4-Hydroxy-2-methylphenyl);ethanoneCHEMBL478074 inverted exclamation marka-Hydroxy-2 inverted exclamation marka-methylacetophenone1-(4-Hydroxy-2-methyl-phenyl)-ethanoneNSC633641-(4-Hydroxy-2-methyl-phenyl)ethanoneUNII-8K85H86ZEDSCHEMBL961292-methyl-4hydroxyacetophenone
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