Cas no 39190-45-9 (1,3-Dioxolane, 4,5-bis(bromomethyl)-2,2-dimethyl-, cis-)
39190-45-9 structure
Product Name:1,3-Dioxolane, 4,5-bis(bromomethyl)-2,2-dimethyl-, cis-
CAS No:39190-45-9
MF:C7H12Br2O2
MW:287.976981163025
CID:1499788
PubChem ID:22870455
Update Time:2025-04-21
1,3-Dioxolane, 4,5-bis(bromomethyl)-2,2-dimethyl-, cis- Chemical and Physical Properties
Names and Identifiers
-
- (4S,5R)-4,5-bis(bromomethyl)-2,2-dimethyl-1,3-dioxolane
- 1,3-Dioxolane, 4,5-bis(bromomethyl)-2,2-dimethyl-, cis-
- (4R,5S)-4,5-Bis(bromomethyl)-2,2-dimethyl-1,3-dioxolane
- DTXSID60628704
- SCHEMBL8893696
- 39190-45-9
-
- Inchi： 1S/C7H12Br2O2/c1-7(2)10-5(3-8)6(4-9)11-7/h5-6H,3-4H2,1-2H3/t5-,6+
- InChI Key： NHNZOHJJFWCQNO-OLQVQODUSA-N
- SMILES： BrC[C@H]1[C@@H](CBr)OC(C)(C)O1
Computed Properties
- Exact Mass: 285.92036
- Monoisotopic Mass: 285.92040g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 0
- Hydrogen Bond Acceptor Count: 2
- Heavy Atom Count: 11
- Rotatable Bond Count: 2
- Complexity: 124
- Covalently-Bonded Unit Count: 1
- Defined Atom Stereocenter Count: 2
- Undefined Atom Stereocenter Count : 0
- Defined Bond Stereocenter Count: 0
- Undefined Bond Stereocenter Count: 0
- XLogP3: 2.1
- Topological Polar Surface Area: 18.5?2
Experimental Properties
- PSA: 18.46
1,3-Dioxolane, 4,5-bis(bromomethyl)-2,2-dimethyl-, cis- Related Literature
-
Xingjie Wu,Linzhu Zhou,Yue Su,Chang-Ming Dong J. Mater. Chem. B, 2016,4, 2142-2152
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Chandran Rajendran,Govindaswamy Satishkumar,Charlotte Lang,Eric M. Gaigneaux Catal. Sci. Technol., 2020,10, 2583-2592
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Shivani Sharma,Chia-Ming Wu,Ranjit T. Koodali,N. Rajesh RSC Adv., 2016,6, 26668-26678
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