Cas no 195209-93-9 (Propanedioic acid,2-chloro-, 1,3-bis(1-methylethyl) ester)
195209-93-9 structure
Product Name:Propanedioic acid,2-chloro-, 1,3-bis(1-methylethyl) ester
CAS No:195209-93-9
MF:C9H15ClO4
MW:222.666002511978
CID:116731
PubChem ID:7019536
Update Time:2025-04-18
Propanedioic acid,2-chloro-, 1,3-bis(1-methylethyl) ester Chemical and Physical Properties
Names and Identifiers
-
- Propanedioic acid,2-chloro-, 1,3-bis(1-methylethyl) ester
- dipropan-2-yl 2-chloropropanedioate
- DIISOPROPYL CHLOROMALONATE
- Chloromalonic acid diisopropyl ester
- Propanedioic acid, chloro-, bis(1-methylethyl) ester
- DTXSID60941288
- Dipropan-2-yl chloropropanedioatato
- diisopropyl 2-chloromalonate
- Diisopropylchloromalonate
- 195209-93-9
- FT-0624996
- DIISOPROPYL CHLOROMALONATE: TECH., 90%
-
- Inchi： 1S/C9H15ClO4/c1-5(2)13-8(11)7(10)9(12)14-6(3)4/h5-7H,1-4H3
- InChI Key： KQGSTSBVCSPBCN-UHFFFAOYSA-N
- SMILES： ClC(C(=O)OC(C)C)C(=O)OC(C)C
Computed Properties
- Exact Mass: 222.06600
- Monoisotopic Mass: 222.0658866g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 0
- Hydrogen Bond Acceptor Count: 4
- Heavy Atom Count: 14
- Rotatable Bond Count: 6
- Complexity: 191
- 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: 2.5
- Topological Polar Surface Area: 52.6?2
Experimental Properties
- Boiling Point: 82-84°C 1mm
- PSA: 52.60000
- LogP: 1.49700
Propanedioic acid,2-chloro-, 1,3-bis(1-methylethyl) ester Security Information
- Hazardous Material transportation number：UN 3265
- Hazard Category Code： 34
- Safety Instruction： S26-S36/37/39-S45
- Safety Term：S26;S36/37/39;S45
- Risk Phrases：R34
Propanedioic acid,2-chloro-, 1,3-bis(1-methylethyl) ester Related Literature
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Ji-Ping Wei Nanoscale, 2015,7, 11815-11832
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Tengfei Yu,Yuehan Wu,Wei Li,Bin Li RSC Adv., 2014,4, 34134-34143
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3. 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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Julia M. Yeomans Soft Matter, 2010,6, 703-704
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Goonay Yousefalizadeh,Shideh Ahmadi,Nicholas J. Mosey,Kevin G. Stamplecoskie Nanoscale, 2021,13, 242-252
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