125224-62-6 ((1S,4S)-2-甲基-2,5-二氮杂双环[2.2.1]庚烷二氢溴酸盐,(1S,4S)-2-Methyl-2,5-diazabicyclo[2.2.1]heptane dihydrobromide)

CAS号:
125224-62-6
中文名称:
(1S,4S)-2-甲基-2,5-二氮杂双环[2.2.1]庚烷二氢溴酸盐
英文名称:
(1S,4S)-2-Methyl-2,5-diazabicyclo[2.2.1]heptane dihydrobromide
分子式:
C6H14Br2N2
分子量:
273.99675989151

(1S,4S)-2-甲基-2,5-二氮杂双环[2.2.1]庚烷二氢溴酸盐(125224-62-6)名称与标识符

名称

中文别名:
(1S,4S)-2-甲基-2,5-二氮二环[2.2.1]庚烷二氢溴酸盐;(1S,4S)-2-甲基-2,5-二氮杂双环[2.2.1]庚烷氢溴酸盐(1:2);4-丙基双环己烷甲酸;(1S,4S)-2-甲基-2,5-二氮杂双环[2.2.1]庚烷二氢溴酸盐;
英文别名:
(1S,4S)-2-Methyl-2,5-diazabicyclo[2.2.1]heptane dihydrobromide;(1S)-2-methyl-2,5-diaza-bicyclo[2.2.1]heptane hydrobromide;(1S,4S)-2-Methyl-2,5-diazabicyclo<2.2.1>heptane Dihydrobromide;(1S,4S)-5-METHYL-2,5-DIAZABICYCLO[2.2.1]HEPTANE DIHYDROBROMIDE;(1S,4S)-5-Methyl-2,5-diazabicyclo-[2.2.1]heptane dihydrobromide;2,5-Diazabicyclo[2.2.1]heptane,2-methyl-, hydrobromide (1:2), (1S,4S)-;(1S)-2-methyl-2,5-diazobicyclo[2.2.1]heptane dihydrobromide;(1S,4S)-(+)-2-METHYL-2,5-DIAZABICYCLO[2.2.1]HEPTANE DIHYDROBROMIDE;PBN2011038-01;(1S,4S)-5-Methyl-2,5-diaz...;

标识符

MDL:
MFCD01863510
InChIKey:
WLUAJCSMROZCDP-USPAICOZSA-N
Inchi:
1S/C6H12N2.2BrH/c1-8-4-5-2-6(8)3-7-5;;/h5-7H,2-4H2,1H3;2*1H/t5-,6-;;/m0../s1
SMILES:
Br.Br.N1(C)C[C@@H]2C[C@H]1CN2

(1S,4S)-2-甲基-2,5-二氮杂双环[2.2.1]庚烷二氢溴酸盐(125224-62-6)物化性质

实验特性

  • LogP : 0.88710
  • PSA : 15.27000
  • 熔点 : 258-259 ºC

计算特性

  • 精确分子量 : 192.02600
  • 氢键供体数量 : 1
  • 氢键受体数量 : 2
  • 可旋转化学键数量 : 0
  • 重原子数量 : 10

(1S,4S)-2-甲基-2,5-二氮杂双环[2.2.1]庚烷二氢溴酸盐(125224-62-6)安全信息

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