426226-35-9 ((methyl (1R,4S)-4-aminocyclopent-2-ene-1-carboxylate;hydrochloride)

CAS号:
426226-35-9
英文名称:
methyl (1R,4S)-4-aminocyclopent-2-ene-1-carboxylate;hydrochloride
分子式:
C7H12ClNO2
分子量:
177.628681182861

methyl (1R,4S)-4-aminocyclopent-2-ene-1-carboxylate;hydrochloride(426226-35-9)名称与标识符

名称

英文别名:
(1R,4S)-methyl 4-aminocyclopent-2-enecarboxylate hydrochloride;(1R,4S)-METHYL 4-AMINOCYCLOPENT-2-ENECARBOXYLATE (HYDROCHLORIDE);Methyl (1R,4S)-4-amino-2-cyclopentene-1-carboxylate hydrochloride (1:1);methyl (1R,4S)-4-aminocyclopent-2-ene-1-carboxylate;hydrochloride;P16224;AKOS027324196;MFCD18207147;AS-53230;BSA22635;Methyl (1R,4S)-4-aminocyclopent-2-ene-1-carboxylate HCl;77745-25-6;SCHEMBL4426352;EN300-7414682;methyl (1R,4S)-4-aminocyclopent-2-ene-1-carboxylate hydrochloride;CS-0005907;SWYRZYIXFKDJEK-RIHPBJNCSA-N;(1R,4S)-4-Amino-2-cyclopentene-1-carboxylic Acid Methyl Ester Hydrochloride;Methyl cis-4-Amino-2-cyclopentenecarboxylate HCl;Methyl (1R,4S)-4-Aminocyclopent-2-ene-1-carboxylate Hydrochloride; 2-Cyclopentene-1-carboxylic acid, 4-amino-, methyl ester, hydrochloride;cis-Methyl 4-aminocyclopent-2-enecarboxylate hydrochloride;(1R,4S)-methyl4-aminocyclopent-2-enecarboxylatehydrochloride;426226-35-9;

标识符

MDL:
MFCD18207147
InChIKey:
SWYRZYIXFKDJEK-RIHPBJNCSA-N
Inchi:
1S/C7H11NO2.ClH/c1-10-7(9)5-2-3-6(8)4-5;/h2-3,5-6H,4,8H2,1H3;1H/t5-,6+;/m0./s1
SMILES:
Cl.O(C)C([C@H]1C=C[C@H](C1)N)=O

methyl (1R,4S)-4-aminocyclopent-2-ene-1-carboxylate;hydrochloride(426226-35-9)物化性质

计算特性

  • 精确分子量 : 177.0556563g/mol
  • 氢键供体数量 : 2
  • 氢键受体数量 : 3
  • 可旋转化学键数量 : 2
  • 同位素质量 : 177.0556563g/mol
  • 重原子数量 : 11
  • 复杂度 : 165
  • 同位素原子数量 : 0
  • 确定原子立构中心数量 : 2
  • 不确定原子立构中心数量 : 0
  • 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 : 2
  • 拓扑分子极性表面积 : 52.3Ų

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methyl (1R,4S)-4-aminocyclopent-2-ene-1-carboxylate;hydrochloride(426226-35-9)参考资料

Beilstein:
M176464
PubChem CID: