uspto-grants-1997_04 · 10.6084/m9.figshare.5104873.v1 · US05624943
查看IDENTITY
结构与身份
- 标准SMILES
- CC(C)=CCCC(C)CCBr
- InChIKey
- QPKCDMXLSDFCQD-UHFFFAOYSA-N
- 分子式
- C10H19Br
- 平均分子量
- 219.16 g/mol
- 单同位素质量
- 218.06701
COMPUTED
结构计算性质
- XLogP
- 4.6
- 极性表面积
- 0 Ų
- 氢键供体
- 0
- 氢键受体
- 0
- 可旋转键
- 5
- 重原子
- 11
- 形式电荷
- 0
- 复杂度
- 112
物化、安全与法规信息正在同步。
ALIASES
名称与别名
8-bromo-2,6-dimethyloct-2-enecitronellyl bromide4895-14-12-Octene,8-bromo-2,6-dimethyl-, (6R)-1-bromo-3,7-dimethyl-6-octene(R)-(-)-CITRONELLYLBROMIDEcitronellylbromide8-Bromo-2,6-dimethyl-2-octeneSCHEMBL12639653,7-dimethyloct-6-enyl bromide1-bromo-(3RS)-3,7-dimethyl-6-octene(+/-) 1-bromo-3,7-dimethyl-6-octeneDB-040452DB-063485EN300-1939299F567285
REACTIONS
相关反应
Training data from https://doi.org/10.1039/C8SC04228D (6/10) · 10.1039/C8SC04228D
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查看uspto-grants-2011_03 · 10.6084/m9.figshare.5104873.v1 · US07902363B2
查看Training data from https://doi.org/10.1039/C8SC04228D (3/10) · 10.1039/C8SC04228D
查看Test data from https://doi.org/10.1039/C8SC04228D · 10.1039/C8SC04228D
查看uspto-grants-1977_01 · 10.6084/m9.figshare.5104873.v1 · US04001339
查看uspto-grants-1977_01 · 10.6084/m9.figshare.5104873.v1 · US04005150
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