30403-01-1 (乙酮,1-[2,4-二羟基-6-甲氧基-3-(3-甲基-2-丁烯-1-基)苯基]-,Ethanone,1-[2,4-dihydroxy-6-methoxy-3-(3-methyl-2-buten-1-yl)phenyl]-)

CAS号:
30403-01-1
中文名称:
乙酮,1-[2,4-二羟基-6-甲氧基-3-(3-甲基-2-丁烯-1-基)苯基]-
英文名称:
Ethanone,1-[2,4-dihydroxy-6-methoxy-3-(3-methyl-2-buten-1-yl)phenyl]-
分子式:
C14H18O4
分子量:
250.290324687958
植物源:

乙酮,1-[2,4-二羟基-6-甲氧基-3-(3-甲基-2-丁烯-1-基)苯基]-(30403-01-1)名称与标识符

名称

英文别名:
Ethanone,1-[2,4-dihydroxy-6-methoxy-3-(3-methyl-2-buten-1-yl)phenyl]-;Acetophenone,2',4'-dihydroxy-6'-methoxy-3'-(3-methyl-2-butenyl)- (6CI,8CI);Ethanone, 1-[2,4-dihydroxy-6-methoxy-3-(3-methyl-2-butenyl)phenyl]-(9CI);Preremirol;1-[2,4-Dihydroxy-6-methoxy-3-(3-methyl-2-butenyl)phenyl]ethanone;Ethanone, 1-[2,4-dihydroxy-6-methoxy-3-(3-methyl-2-buten-1-yl)phenyl]-;

标识符

InChIKey:
KASLWEHUDINBOP-UHFFFAOYSA-N
Inchi:
1S/C14H18O4/c1-8(2)5-6-10-11(16)7-12(18-4)13(9(3)15)14(10)17/h5,7,16-17H,6H2,1-4H3
SMILES:
C(=O)(C1=C(OC)C=C(O)C(C/C=C(/C)\C)=C1O)C

乙酮,1-[2,4-二羟基-6-甲氧基-3-(3-甲基-2-丁烯-1-基)苯基]-(30403-01-1)物化性质

实验特性

  • PSA : 66.76
  • 沸点 : 403.5±35.0 °C(Predicted)
  • 熔点 : 169-170 °C
  • 酸度系数(pKa) : 8.15±0.28(Predicted)
  • 密度 : 1.150±0.06 g/cm3(Predicted)

计算特性

  • 精确分子量 : 250.12054