Cas no 53894-19-2 (2-Propanol, 1,1-dichloro-)
2-Propanol, 1,1-dichloro- structure
Product Name:2-Propanol, 1,1-dichloro-
CAS No:53894-19-2
MF:C3H6Cl2O
MW:128.985139369965
CID:356109
PubChem ID:12931971
Update Time:2025-04-19
2-Propanol, 1,1-dichloro- Chemical and Physical Properties
Names and Identifiers
-
- 2-Propanol, 1,1-dichloro-
- 1,1-dichloropropan-2-ol
- DTXSID60513287
- SCHEMBL186198
- ZOKHGHDRKCYWTH-UHFFFAOYSA-N
- 1,1-DICHLORO-2-PROPANOL
- 53894-19-2
- 3-dichloroisopropanol
-
- Inchi： 1S/C3H6Cl2O/c1-2(6)3(4)5/h2-3,6H,1H3
- InChI Key： ZOKHGHDRKCYWTH-UHFFFAOYSA-N
- SMILES： ClC(C(C)O)Cl
Computed Properties
- Exact Mass: 127.97968
- Monoisotopic Mass: 127.9795702g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 1
- Hydrogen Bond Acceptor Count: 1
- Heavy Atom Count: 6
- Rotatable Bond Count: 1
- Complexity: 37.8
- 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: 1.3
- Topological Polar Surface Area: 20.2?2
Experimental Properties
- PSA: 20.23
2-Propanol, 1,1-dichloro- Related Literature
-
Gloria Belén Ramírez-Rodríguez,José Manuel Delgado-López,Jaime Gómez-Morales CrystEngComm, 2013,15, 2206-2212
-
Zhiyan Chen,Nan Wu,Yaobing Wang,Bing Wang,Yingde Wang J. Mater. Chem. A, 2018,6, 516-526
-
Jason Wan Lab Chip, 2020,20, 4528-4538
-
Qiaoe Wang,Meiling Lian,Xiaowen Zhu,Xu Chen RSC Adv., 2021,11, 192-197
-
Guiying Zhang,Maosheng Cheng,Yanni Li,Keliang Liu,Lifeng Cai Chem. Commun., 2013,49, 11086-11088
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