Cas no 69614-00-2 (Phosphorodichloridic acid, 3-chloropropyl ester)
69614-00-2 structure
Product Name:Phosphorodichloridic acid, 3-chloropropyl ester
CAS No:69614-00-2
MF:C3H6Cl3O2P
MW:211.411299228668
CID:4150077
PubChem ID:20283548
Update Time:2025-04-24
Phosphorodichloridic acid, 3-chloropropyl ester Chemical and Physical Properties
Names and Identifiers
-
- Phosphorodichloridic acid, 3-chloropropyl ester
- 3-chloropropyl phosphorodichloridate
- 69614-00-2
- SCHEMBL10933894
- SY299109
- LCVBPSKTKGXIDD-UHFFFAOYSA-N
-
- Inchi： 1S/C3H6Cl3O2P/c4-2-1-3-8-9(5,6)7/h1-3H2
- InChI Key： LCVBPSKTKGXIDD-UHFFFAOYSA-N
- SMILES： ClCCCOP(=O)(Cl)Cl
Computed Properties
- Exact Mass: 209.917100Da
- Monoisotopic Mass: 209.917100Da
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 0
- Hydrogen Bond Acceptor Count: 2
- Heavy Atom Count: 9
- Rotatable Bond Count: 4
- Complexity: 112
- 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: 1.9
- Topological Polar Surface Area: 26.3?2
Phosphorodichloridic acid, 3-chloropropyl ester Related Literature
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Jason Y. C. Lim,Yong Yu,Guorui Jin,Kai Li,Yi Lu,Jianping Xie Nanoscale Adv., 2020,2, 3921-3932
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Alexandre Vimont,Arnaud Travert,Philippe Bazin,Jean-Claude Lavalley,Marco Daturi,Christian Serre,Gérard Férey,Sandrine Bourrelly,Philip L. Llewellyn Chem. Commun., 2007, 3291-3293
-
Weili Dai,Guangjun Wu,Michael Hunger Chem. Commun., 2015,51, 13779-13782
-
Chen-Yu Chien,Sheng-Sheng Yu Chem. Commun., 2020,56, 11949-11952
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