名称和标识符别名信息物化性质安全信息相关文献专业数据库参考相关分类相关产品

1,3-二甲氧基-2-丙醇 | 623-69-8

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中文名称： 1,3-二甲氧基-2-丙醇

英文名称： 1,3-dimethoxypropan-2-ol

CAS No.： 623-69-8

分子式： C₅H₁₂O₃

分子量： 120.1470

如需查看该化合物的详细结构式,mol文件,smile,InChi 请点击：1,3-二甲氧基-2-丙醇结构式

PubChem CID： 12190

价格行情： 1,3-二甲氧基-2-丙醇价格

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1,3-二甲氧基-2-丙醇的其他展现形式

相关化合物

3-甲氧基-1,2-丙二醇

3-Methoxypropane-1,2-diol

CAS No.：623-39-2
1,3-二乙氧基-2-丙醇

1,3-Diethoxypropan-2-ol

CAS No.：4043-59-8
(S)-(+)环氧丙基甲基醚

(S)-(+)-methylglycidyl ether

CAS No.：64491-68-5
(S)-(+)-1-甲氧基-2-丙醇

(S)-(-)-1-Methoxy-2-propanol

CAS No.：26550-55-0
(R)-(-)环氧丙基甲基醚

(R)-Glycidyl Methyl Ether

CAS No.：64491-70-9
(R)-(-)-1-甲氧基-2-丙醇

(R)-(-)-1-METHOXY-2-PROPANOL

CAS No.：4984-22-9

名称和标识符

MDL	MFCD01076303
InChIKey	ZESKRVSPQJVIMH-UHFFFAOYSA-N
Inchi	1S/C5H12O3/c1-7-3-5(6)4-8-2/h5-6H,3-4H2,1-2H3
SMILES	O(C([H])([H])[H])C([H])([H])C([H])(C([H])([H])OC([H])([H])[H])O[H]

别名信息

- 中文别名 -

1,3-二甲氧基-2-丙醇
2-[(甲氨基)甲基]苯甲醇
1,3-二甲基甘油醚
甘油二甲醚

- 英文别名 -

1,3-Dimethoxypropan-2-ol
1,3-DIMETHOXY-2-PROPANOL
1,3-Dimethoxy-2-hydroxypropane
Glycerol 1,3-dimethyl ether
NSC 263483

2-Propanol, 1,3-dimethoxy-
A0JF0DT9XK
ZESKRVSPQJVIMH-UHFFFAOYSA-N
Glycerin 1,3-dimethyl ether
NSC263483
2-Propanol,3-dimethoxy-
1,3-dimethoxy-propan-2-ol
KSC495K2B
RW3890
TRA0054058
SY021402
1,3-dimethoxypropan-2-ol
AI3-03551
Q27273467
BCP31720
AS-17261
1,3-dimethoxypropan-2-ol
2-Propanol, 1,3-dimethoxy-
Glycerin 1,3-dimethyl ether
1,3-dimethoxy-2-hydroxypropane
1,3-Dimethoxy-d6-2-propanol
CS-W018661
623-69-8
DTXSID30211364
glycerol-1,3-dimethyl ether
NSC-263483
MFCD01076303
SY357427
FT-0652031
A8628
UNII-A0JF0DT9XK
SCHEMBL55052
AMY25050
NS00127163
2-(1H-Indol-3-yl)-2-oxo-ethylaminehydrochloride
AKOS006345951
EN300-97405
1 pound not3-Dimethoxypropan-2-ol

物化性质

实验特性

LogP	-0.35990
PSA	38.69000
折射率	1.4231
沸点	169°C (estimate)
熔点	No data available
闪点	58.2±23.2 °C
颜色与性状	No data available
密度	1.0085

计算特性

精确分子量	120.07900
氢键供体数量	1
氢键受体数量	3
可旋转化学键数量	4
同位素质量	120.079
重原子数量	8
复杂度	40.9
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）	-0.7
互变异构体数量	无
表面电荷	0
拓扑分子极性表面积	38.7

安全信息

安全说明	S16
风险术语	R10
危险品运输编号	UN 1987
危害声明	H302+H312+H332-H315-H319-H335
警示性声明	P261; P264; P271; P280; P302+P352; P304+P340; P305+P351+P338; P312; P321; P332+P313; P337+P313; P362; P403+P233; P405; P501
储存条件	Sealed in dry,Room Temperature
危险类别码	10
信号词	Warning

相关文献

1. Addition of electrophiles to unsymmetric alkenes. Effects of β oxygen substituents on the stereo- and regio-chemistry of positive halogen addition
(The late) John Hudec,John W. Liebeschuetz J. Chem. Soc. Perkin Trans. 2 1998 1139
2. Solvatochromic parameters for solvents of interest in green chemistry
Philip G. Jessop,David A. Jessop,Dongbao Fu,Lam Phan Green Chem. 2012 14 1245
3. Perspectives on the replacement of harmful organic solvents in analytical methodologies: a framework toward the implementation of a generation of eco-friendly alternatives
Francisco Pena-Pereira,Adam Kloskowski,Jacek Namie?nik Green Chem. 2015 17 3687
4. The impact of size and shape in the performance of hydrotropes: a case-study of alkanediols
Dinis O. Abranches,Bruna P. Soares,Ana M. Ferreira,Seishi Shimizu,Sim?o P. Pinho,Jo?o A. P. Coutinho Phys. Chem. Chem. Phys. 2022 24 7624
5. Quantitative structure–property relationships prediction of some physico-chemical properties of glycerol based solvents
José I. García,Héctor García-Marín,José A. Mayoral,Pascual Pérez Green Chem. 2013 15 2283
6. 1,2,3-Trimethoxypropane: a bio-sourced glyme as electrolyte for lithium–O2 batteries
Marta Alvarez-Tirado,Laurent Castro,Shuai Qian,Jason E. Bara,Marco Di Gennaro,Konstantinos Gkagkas,Aurélie Guéguen,David Mecerreyes Green Chem. 2022 24 6016
7. Effect of branching in remote substituents on light emission and stability of chemiluminescent acridinium esters
Anand Natrajan,David Wen RSC Adv. 2014 4 21852
8. Dimethyl carbonate: a versatile reagent for a sustainable valorization of renewables
G. Fiorani,A. Perosa,M. Selva Green Chem. 2018 20 288
9. Glycerol-based solvents as green reaction media in epoxidations with hydrogen peroxide catalysed by bis[3,5-bis(trifluoromethyl)-diphenyl] diselenide
Héctor García-Marín,John C. van der Toorn,José A. Mayoral,José I. García,Isabel W. C. E. Arends Green Chem. 2009 11 1605
10. Synthesis of 2,5-dihydrofurans via alkylidene carbene insertion reactions
Louise F. Walker,Ahmed Bourghida,Stephen Connolly,Martin Wills J. Chem. Soc. Perkin Trans. 1 2002 965

专业数据库参考

PubChemId	12190

1,3-二甲氧基-2-丙醇 | 623-69-8

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