Cas no 146490-38-2 (1,2-Propanediol, 3-[3-(hexyloxy)-2-hydroxypropoxy]-)
![1,2-Propanediol, 3-[3-(hexyloxy)-2-hydroxypropoxy]- structure](https://ossimg.kuujia.com/scimg/146500/146490-38-2x500.png)
146490-38-2 structure
Product Name:1,2-Propanediol, 3-[3-(hexyloxy)-2-hydroxypropoxy]-
CAS No:146490-38-2
MF:C12H26O5
MW:250.331844806671
CID:3764999
PubChem ID:10243842
Update Time:2025-04-22
1,2-Propanediol, 3-[3-(hexyloxy)-2-hydroxypropoxy]- Chemical and Physical Properties
Names and Identifiers
-
- 1,2-Propanediol, 3-[3-(hexyloxy)-2-hydroxypropoxy]-
- DB-204084
- 3-[3-(Hexyloxy)-2-hydroxypropoxy]-1,2-propanediol
- 146490-38-2
- SCHEMBL441361
-
- Inchi： 1S/C12H26O5/c1-2-3-4-5-6-16-9-12(15)10-17-8-11(14)7-13/h11-15H,2-10H2,1H3
- InChI Key： ONTIRIQDMWYCQQ-UHFFFAOYSA-N
- SMILES： C(O)C(O)COCC(O)COCCCCCC
Computed Properties
- Exact Mass: 250.17802393Da
- Monoisotopic Mass: 250.17802393Da
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 3
- Hydrogen Bond Acceptor Count: 5
- Heavy Atom Count: 17
- Rotatable Bond Count: 12
- Complexity: 154
- Covalently-Bonded Unit Count: 1
- Defined Atom Stereocenter Count: 0
- Undefined Atom Stereocenter Count : 2
- Defined Bond Stereocenter Count: 0
- Undefined Bond Stereocenter Count: 0
- XLogP3: 0.3
- Topological Polar Surface Area: 79.2?2
1,2-Propanediol, 3-[3-(hexyloxy)-2-hydroxypropoxy]- Related Literature
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Bruce Parkinson Energy Environ. Sci., 2010,3, 509-511
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Tao Wang,Yangyang Liu,Yue Deng,Hongbo Fu,Jianmin Chen Environ. Sci.: Nano, 2018,5, 1821-1833
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Kay S. McMillan,Anthony G. McCluskey,Annette Sorensen,Marie Boyd,Michele Zagnoni Analyst, 2016,141, 100-110
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Hui Liu,Deyong Su,Guolin Cheng,Jimin Xu,Xinyan Wang,Yuefei Hu Org. Biomol. Chem., 2010,8, 1899-1904
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J. Zagora,M. Vosla?,L. Schreiberová,I. Schreiber Phys. Chem. Chem. Phys., 2002,4, 1284-1291
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