2,2-二甲基-1,3-苯并二氧戊环 | 14005-14-2
中文名称:
2,2-二甲基-1,3-苯并二氧戊环
英文名称:
2,2-Dimethylbenzod1,3dioxole
CAS No.:
14005-14-2
分子式:
C9 H1 0 O2
分子量:
150.1745
名称和标识符
MDL
MFCD08061594
InChIKey
BWBIFYYKIWPTRV-UHFFFAOYSA-N
Inchi
1S/C9H10O2/c1-9(2)10-7-5-3-4-6-8(7)11-9/h3-6H,1-2H3
SMILES
O1C2=C([H])C([H])=C([H])C([H])=C2OC1(C([H])([H])[H])C([H])([H])[H]
别名信息
- 中文别名 -
2,2-二甲基-1,3-苯并二氧戊环
2,2-二甲基-1,3-苯并二恶茂烷
2,2-Dimethyl-1,3-benzodioxole 2,2-二甲基-1,3-苯并二氧戊环
2,2-二甲基-1,3-苯并二氧
4-甲基-2-噻唑甲醛
- 英文别名 -
2,2-Dimethylbenzo[d][1,3]dioxole
2,2-Dimethyl-1,3-benzodioxole
2,2-DIMETHYL-1,3-BENZODIOXAZOLE
1,2-(Isopropylidenedioxy)benzene
Benzene,1,2-(isopropylidenedioxy)- (8CI)
NSC 143506
2,2-DIMETHYL-1,3-BENZODIOXOLE, 98.0+%(GC)
1,3-Benzodioxole, 2,2-dimethyl-
2,2-dimethyl-2H-1,3-benzodioxole
NSC143506
BWBIFYYKIWPTRV-UHFFFAOYSA-
BWBIFYYKIWPTRV-UHFFFAOYSA-N
1,3-Benzodioxole,2,2-dimethyl-
2,2-dimethylbenzo[d]1,3-dioxolane
ST2408987
A
2,2-DIMETHYL-1,3-BENZODIOXOLE
2,2-Dimethyl-1,3-Benzodioxazole
1,2-(ISOPROPYLIDENEDIOXY)BENZENE
2,2-DiMethylbenzo[d][1,3]dioxole
AKOS015889844
14005-14-2
MFCD08061594
FT-0658684
EN300-115462
InChI=1/C9H10O2/c1-9(2)10-7-5-3-4-6-8(7)11-9/h3-6H,1-2H3
A807617
AS-33308
2,2-dimethyl-1,3-dioxaindane
SCHEMBL370061
Z1255424302
NSC-143506
SY043089
D3421
DTXSID20301445
CS-0153772
物化性质
实验特性
LogP
2.19390
PSA
18.46000
折射率
1.5050-1.5090
沸点
182°C(lit.)
熔点
3°C(lit.)
闪点
69 °C
颜色与性状
未确定
溶解性
未确定
密度
1.06
计算特性
精确分子量
150.06800
氢键供体数量
0
氢键受体数量
2
可旋转化学键数量
0
同位素质量
150.068
重原子数量
11
复杂度
138
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
1
疏水参数计算参考值(XlogP)
2.4
互变异构体数量
无
表面电荷
0
拓扑分子极性表面积
18.5
海关数据
海关编码
2932999099
海关数据
中国海关编码:
2932999099
概述:
2932999099. 其他仅含氧杂原子的杂环化合物. 增值税率:17.0%. 退税率:13.0%. 监管条件:无. 最惠国关税:6.5%. 普通关税:20.0%
申报要素:
品名, 成分含量, 用途
Summary:
2932999099. other heterocyclic compounds with oxygen hetero-atom(s) only. VAT:17.0%. Tax rebate rate:13.0%. . MFN tariff:6.5%. General tariff:20.0%
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参考资料
Reaxys RN
112486
Beilstein
19(5)1,455
化合物详情(旧版)
SMILES
CC1(C)OC2C(=CC=CC=2)O1