139633-72-0 (2-(7-Methoxy-1-naphthyl)propanoic acid,2-(7-methoxy-1-naphthyl)propanoic Acid)

CAS号:
139633-72-0
中文名称:
2-(7-Methoxy-1-naphthyl)propanoic acid
英文名称:
2-(7-methoxy-1-naphthyl)propanoic Acid
分子式:
C14H14O3
分子量:
230.259164333344

2-(7-Methoxy-1-naphthyl)propanoic acid(139633-72-0)名称与标识符

名称

中文别名:
2-(7-Methoxy-1-naphthyl)propanoic acid;
英文别名:
2-(7-methoxy-1-naphthyl)propanoic Acid;ANW-46772;SureCN577758;2-(7-methoxynaphth-1-yl)ethylamine hydrochloride;2-(7-methoxynaphthalen-1-yl)propanoic acid;2-(7-methoxy-[1]naphthyl)-ethylamine, hydrochloride;2-(7-methoxynanphthyl)ethanamine hydrochloride;2-(7-METHOXY-1-NAPHTHYL)ETHYLAMINE HYDROCHLORIDE;CTK4C1844;7-Methoxy-1-naphthaleneethanamine HCl;ACMC-209wsm;AGN-PC-00S5UA;2-(7-methoxynaphthalen-1-yl)ethanamine hydrochloride;2-(7'-methoxy-1'-naphthyl)propanoic acid;1-(2-aminoethyl)-7-methoxynaphthalene hydrochloride;2-(7-methoxynaphthalen-1-yl)ethylamine hydrochloride;1-Naphthaleneethanamine,7-methoxy-, hydrochloride (1:1);ANW-46772; SureCN577758; 2-(7-methoxynaphth-1-yl)ethylamine hydrochloride; 2-(7-methoxynaphthalen-1-yl)propanoic acid; 2-(7-methoxy-[1]naphthyl)-ethylamine, hydrochloride; 2-(7-methoxynanphthyl)ethanamine hydrochloride; 2-(7-METHOXY-1-NAPHTHYL)ETHYLAMINE HYDROCHLORIDE; CTK4C1844; 7-Methoxy-1-naphthaleneethanamine HCl; ACMC-209wsm; AGN-PC-00S5UA; 2-(7-methoxynaphthalen-1-yl)ethanamine hydrochloride; 2-(7'-methoxy-1'-naphthyl)propanoic ac;139633-72-0;DB-085305;SCHEMBL299431;2-(7-Methoxy-1-naphthyl)propanoicacid;

标识符

InChIKey:
ZJTGRYUHMAIZLW-UHFFFAOYSA-N
Inchi:
1S/C14H14O3/c1-9(14(15)16)12-5-3-4-10-6-7-11(17-2)8-13(10)12/h3-9H,1-2H3,(H,15,16)
SMILES:
O(C)C1C=CC2=CC=CC(=C2C=1)C(C(=O)O)C

2-(7-Methoxy-1-naphthyl)propanoic acid(139633-72-0)物化性质

计算特性

  • 精确分子量 : 230.094294304g/mol
  • 氢键供体数量 : 1
  • 氢键受体数量 : 3
  • 可旋转化学键数量 : 3
  • 同位素质量 : 230.094294304g/mol
  • 重原子数量 : 17
  • 复杂度 : 277
  • 同位素原子数量 : 0
  • 确定原子立构中心数量 : 0
  • 不确定原子立构中心数量 : 1
  • 确定化学键立构中心数量 : 0
  • 不确定化学键立构中心数量 : 0
  • 共价键单元数量 : 1
  • 疏水参数计算参考值(XlogP) : 3.2
  • 拓扑分子极性表面积 : 46.5Ų