1335-94-0 (鸢尾酮,Irone)

快速询单

结构式：

鸢尾酮MOL文件

CAS号：

1335-94-0

中文名称：

鸢尾酮

英文名称：

Irone

分子式：

C₁₃H₂₂O

分子量：

194.313184261322

鸢尾酮(1335-94-0)名称与标识符

名称

中文别名：

鸢尾酮;

英文别名：

Irone;ALPHA-IRONE;4-(2,5,6,6-tetramethylcyclohex-2(or-1)-en-1-yl)but-3-en-2-one;5-methylionone;

标识符

InChIKey：

YJRODKCOICMRBO-BQYQJAHWSA-N

Inchi：

1S/C13H22O/c1-10-6-5-9-13(3,4)12(10)8-7-11(2)14/h7-8,10,12H,5-6,9H2,1-4H3/b8-7+

SMILES：

O=C(/C=C/C1C(C)(C)CCCC1C)C

鸢尾酮(1335-94-0)物化性质

实验特性

沸点 : 116-118 °C(Press: 3 Torr)
密度 : 0.915 g/cm3(Temp: 25 °C)

计算特性

精确分子量 : 206.167065
氢键供体数量 : 0
氢键受体数量 : 1
可旋转化学键数量 : 3
同位素质量 : 206.167065
重原子数量 : 15
复杂度 : 295
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 : 1
确定化学键立构中心数量 : 1
不确定化学键立构中心数量 : 0
共价键单元数量 : 1
拓扑分子极性表面积 : 17.1

鸢尾酮(1335-94-0)推荐厂家更多厂家(1)

公司名称	手机号/电话	联系人	QQ	微信	询单
深圳市瑞吉特生物科技有限公司	15813841136 0755-89459231	钦先生	1029374309		询单

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