大麦芽碱盐酸盐 | 6027-23-2
大麦芽碱盐酸盐
2-(4-Hydroxyphenyl)-N,N-dimethylethylamine Hydrochloride
6027-23-2
C10H16ClNO
201.6931
名称和标识符
MDL |
MFCD00040807 |
InChIKey |
KIZRJFIRFPIRFS-UHFFFAOYSA-N |
Inchi |
1S/C10H15NO.ClH/c1-11(2)8-7-9-3-5-10(12)6-4-9;/h3-6,12H,7-8H2,1-2H3;1H |
SMILES |
Cl[H].O([H])C1C([H])=C([H])C(=C([H])C=1[H])C([H])([H])C([H])([H])N(C([H])([H])[H])C([H])([H])[H] |
别名信息
- 中文别名 -
- 大麦芽碱盐酸盐
- 4-(2-二甲基氨基乙基)苯酚盐酸盐
- 大麦芽碱盐酸盐 标准品
- 大麦芽碱盐酸盐又名二甲基酪胺盐酸盐
- 大麦芽碱盐酸
- 英文别名 -
- 4-(2-(Dimethylamino)ethyl)phenol hydrochloride
- 2-(4-Hydroxyphenyl)-N,N'-dimethylethylamine hydrochloride
- 4-[2-(Dimethylamino)ethyl]phenol hydrochloride
- Hordenine-d6HCl
- Phenol, 4-[2-(dimethylamino)ethyl]-, hydrochloride
- Hordenine hydrochloride
- Anhaline hydrochloride
- Eremursine hydrochloride
- Hordenin*HCl
- Hordenine HCl
- Hordeninhydrochlorid
- N,N-Dimethyltyramine hydrochloride
- Peyocactine hydrochloride
- p-Hordenine hydrochloride
- 4-[2-(dimethylamino)ethyl]phenol
- hydrochloride
- 2-(4-hydroxyphenyl) n,n-dimethylethylaminehydrochloride
- 575FR6P9I9
- 2-(4-hydroxyphenyl)-n,n-dimethyl-ethylamine hydrochloride
- Anhaline HCl
- C10H15NO
- Q27261469
- 2-(4-hydroxyphenyl)-n,n-dimethylethylamine hydrochloride
- 4-[2-(dimethylamino)ethyl]phenol hydrochloride
- EN300-7400776
- Phenol, p-(2-(dimethylamino)ethyl)-, hydrochloride
- NS00081977
- Z1741959541
- Hordenine Hydrochloride (4-Hydroxy-N,N-dimethylphenethylamine Hydrochloride)
- NSC 172175
- DTXSID70209023
- 2-(4-hydroxyphenyl) n,n-dimethyl-ethylaminehydrochloride
- SCHEMBL2478680
- p-Hydroxy-N,N-dimethylphenethylamine hydrochloride
- MFCD00040807
- NSC172175
- CS-0227054
- FT-0635944
- 4-(2-(Dimethylamino)ethyl)phenolhydrochloride
- 2-(4-hydroxyphenyl)-n,n-dimethylethylaminehydrochloride
- 2-(4-Hydroxyphenyl) N,N-dimethyl-ethylamine hydrochloride
- A832663
- BCP22869
- 2-(4-hydroxyphenyl)N,N-dimethyl-ethylamine hydrochloride, AldrichCPR
- PHENOL, 4-(2-(DIMETHYLAMINO)ETHYL)-, HYDROCHLORIDE (1:1)
- EINECS 227-892-6
- Hordenine Hydrochloride
- 4-Hydroxy-N,N-dimethylphenethylamine Hydrochloride
- Anhaline hydrochloride
- Eremursine hydrochloride
- 2-(4-hydroxyphenyl)-n,n'-dimethylethylamine hydrochloride
- Dimethyl-beta-(4-hydroxyphenyl)ethylamine hydrochloride
- NSC-172175
- Hordenine (hydrochloride)
- 6027-23-2
- p-(2-Dimethylaminoethyl)phenol hydrochloride
- hordenin hydrochloride
- GS-0926
- Hordenine Hydrochloride (4-Hydroxy-N,N-dimethylphenethylamine Hydrochloride) 1.0 mg/ml in Methanol (as free base)
- HY-N0113B
- AKOS015889411
- 2-(4-hydroxyphenyl)ethyl-dimethylazanium
- chloride
- AC-28905
- Phenol, 4-(2-(dimethylamino)ethyl)-, hydrochloride
- BCP9000078
- HORDENINE HYDROCHLORIDE [MI]
- UNII-575FR6P9I9
物化性质
实验特性
LogP |
2.29830 |
PSA |
23.47000 |
熔点 |
178 °C |
颜色与性状 |
未确定 |
溶解性 |
未确定 |
计算特性
精确分子量 |
201.09200 |
氢键供体数量 |
2 |
氢键受体数量 |
2 |
可旋转化学键数量 |
3 |
同位素质量 |
201.0920418 g/mol |
重原子数量 |
13 |
复杂度 |
117 |
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 |
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 |
疏水参数计算参考值(XlogP) |
无 |
互变异构体数量 |
2 |
表面电荷 |
0 |
拓扑分子极性表面积 |
23.5 |
分子量 |
201.69 |
海关数据
海关编码 |
2922199090 |
海关数据 |
中国海关编码:
2923900090
概述:
2923900090 其他季铵盐及季铵碱。监管条件:无。增值税率:17.0%。退税率:9.0%。最惠国关税:6.5%。普通关税:30.0%
申报要素:
品名, 成分含量, 用途
Summary:
2923900090 other quaternary ammonium salts and hydroxides。Supervision conditions:None。VAT:17.0%。Tax rebate rate:9.0%。MFN tariff:6.5%。General tariff:30.0%
|
相关文献
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1.
Combined chemoenzymatic strategy for sustainable continuous synthesis of the natural product hordenine
Stefania Gianolio,David Roura Padrosa,Francesca Paradisi Green Chem. 2022 24 8434
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2.
428. 5-Methoxy-N-methyltryptamine: a new indole alkaloid from Phalaris arundinacea L.
S. Wilkinson J. Chem. Soc. 1958 2079
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