Cas no 19554-99-5 (Propane, 1-chloro-3-(2-chloroethoxy)-)
19554-99-5 structure
Product Name:Propane, 1-chloro-3-(2-chloroethoxy)-
CAS No:19554-99-5
MF:C5H10Cl2O
MW:157.038300037384
CID:1387783
PubChem ID:12284237
Update Time:2025-04-20
Propane, 1-chloro-3-(2-chloroethoxy)- Chemical and Physical Properties
Names and Identifiers
-
- Propane, 1-chloro-3-(2-chloroethoxy)-
- 19554-99-5
- SCHEMBL11082402
- AT34477
- AKOS006381960
- 1-chloro-3-(2-chloroethoxy)propane
-
- Inchi： 1S/C5H10Cl2O/c6-2-1-4-8-5-3-7/h1-5H2
- InChI Key： BSNQVJYYACQGQW-UHFFFAOYSA-N
- SMILES： ClCCCOCCCl
Computed Properties
- Exact Mass: 156.011
- Monoisotopic Mass: 156.0108703g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 0
- Hydrogen Bond Acceptor Count: 1
- Heavy Atom Count: 8
- Rotatable Bond Count: 5
- Complexity: 41.4
- Covalently-Bonded Unit Count: 1
- Defined Atom Stereocenter Count: 0
- Undefined Atom Stereocenter Count : 0
- Defined Bond Stereocenter Count: 0
- Undefined Bond Stereocenter Count: 0
- XLogP3: 1.6
- Topological Polar Surface Area: 9.2?2
Experimental Properties
- PSA: 9.23
Propane, 1-chloro-3-(2-chloroethoxy)- Related Literature
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Amandine Altmayer-Henzien,Valérie Declerck,David J. Aitken,Ewen Lescop,Denis Merlet,Jonathan Farjon Org. Biomol. Chem., 2013,11, 7611-7615
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A. B. F. da Silva,K. Capelle Phys. Chem. Chem. Phys., 2009,11, 4564-4569
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Shun-Ze Zhan,Mian Li,Xiao-Ping Zhou,Dan Li,Seik Weng Ng RSC Adv., 2011,1, 1457-1459
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Manickam Bakthadoss,Tadiparthi Thirupathi Reddy,Vishal Agarwal,Duddu S. Sharada Chem. Commun., 2022,58, 1406-1409
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5. Estimating and correcting interference fringes in infrared spectra in infrared hyperspectral imagingGhazal Azarfar,Ebrahim Aboualizadeh,Nicholas M. Walter,Simona Ratti,Camilla Olivieri,Alessandra Norici,Michael Nasse,Achim Kohler,Mario Giordano Analyst, 2018,143, 4674-4683
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