Cas no 1331-17-5 ((2-Propenyloxy)propanol)
(2-Propenyloxy)propanol structure
Product Name:(2-Propenyloxy)propanol
(2-Propenyloxy)propanol Chemical and Physical Properties
Names and Identifiers
-
- (2-Propenyloxy)propanol
- Propylene glycol monoallyl ether
- Propanol,1(or 2)-(2-propenyloxy)
- PROPYLENE GLYCOL,ALLYL ETHER
- Propanol, 1(or 2)-(2-propenyloxy)-
- Allylether propylenglykolu
- Propylene glycol allyl ether
- SCHEMBL3141675
- Propanol, (2-propenyloxy)-
- Allylether propylenglykolu [Czech]
- 43089-73-2
- 1-Propanol, 2-(2-propenyloxy)-
- 2-prop-2-enoxypropan-1-ol
- UNII-40OO0TPA8G
- NS00120495
- 3S828A523X
- PROPYLENE GLYCOL, ALLYL ETHER
- HSDB 6333
- 2-(Allyloxy)-1-propanol
- 2-(allyloxy)propanol
- 1331-17-5
- UNII-3S828A523X
- DTXSID60862641
- Propanol, (allyloxy)-
- 40OO0TPA8G
- Dowanol PA-T
- Propanol, allyloxy-
- Allyl ether of propylene glycol
- 1,2-Propanediol, allyl ether
- 1-Propanol, 2-(2-propen-1-yloxy)-
- Q27257972
- Propylene glycol 2-allyl ether
-
- Inchi： 1S/C6H12O2/c1-3-4-8-6(2)5-7/h3,6-7H,1,4-5H2,2H3
- InChI Key： BQKZEKVKJUIRGH-UHFFFAOYSA-N
- SMILES： O(CC=C)C(C)CO
Computed Properties
- Exact Mass: 116.08400
- Monoisotopic Mass: 116.083729621g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 1
- Hydrogen Bond Acceptor Count: 2
- Heavy Atom Count: 8
- Rotatable Bond Count: 4
- Complexity: 61.5
- Covalently-Bonded Unit Count: 1
- Defined Atom Stereocenter Count: 0
- Undefined Atom Stereocenter Count : 1
- Defined Bond Stereocenter Count: 0
- Undefined Bond Stereocenter Count: 0
- XLogP3: 0.5
- Topological Polar Surface Area: 29.5?2
Experimental Properties
- Density: 0.9548 (rough estimate)
- Boiling Point: 157.22°C (rough estimate)
- Refractive Index: 1.4030 (estimate)
- PSA: 29.46000
- LogP: 0.56980
(2-Propenyloxy)propanol Security Information
- Hazardous Material transportation number：UN 2810
- HazardClass：6.1(b)
- PackingGroup：III
- Safety Term：6.1(b)
- Packing Group：III
- Packing Group：III
- Hazard Level：6.1(b)
(2-Propenyloxy)propanol Related Literature
-
Shintaro Takata,Yoshihiro Miura Phys. Chem. Chem. Phys., 2014,16, 24784-24789
-
Shun-Ze Zhan,Mian Li,Xiao-Ping Zhou,Dan Li,Seik Weng Ng RSC Adv., 2011,1, 1457-1459
-
Chao-Han Cheng,Wen-Zhen Wang,Shie-Ming Peng,I-Chia Chen Phys. Chem. Chem. Phys., 2017,19, 25471-25477
-
Max Attwood,Hiroki Akutsu,Lee Martin,Toby J. Blundell,Pierre Le Maguere,Scott S. Turner Dalton Trans., 2021,50, 11843-11851
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