Cas no 73430-32-7 (Propanoic acid,3,3'-[1,3-propanediylbis(oxy)]bis-, bis(3-bromopropyl) ester (9CI))
73430-32-7 structure
Product Name:Propanoic acid,3,3'-[1,3-propanediylbis(oxy)]bis-, bis(3-bromopropyl) ester (9CI)
CAS No:73430-32-7
MF:C15H26Br2O6
MW:462.171344280243
CID:579778
PubChem ID:338577
Update Time:2025-04-19
Propanoic acid,3,3'-[1,3-propanediylbis(oxy)]bis-, bis(3-bromopropyl) ester (9CI) Chemical and Physical Properties
Names and Identifiers
-
- Propanoic acid,3,3'-[1,3-propanediylbis(oxy)]bis-, bis(3-bromopropyl) ester (9CI)
- 3-bromopropyl 3-[3-[3-(3-bromopropoxy)-3-oxopropoxy]propoxy]propanoate
- 4,8-dioxa-undecane-1,11-dioic acid bis(3-bromopropyl) ester
- AC1L7O53
- NSC361681
- DTXSID00320593
- NSC 361681
- NSC-361681
- 73430-32-7
-
- Inchi: 1S/C15H26Br2O6/c16-6-1-10-22-14(18)4-12-20-8-3-9-21-13-5-15(19)23-11-2-7-17/h1-13H2
- InChI Key: JWQPELPKLRRFJQ-UHFFFAOYSA-N
- SMILES: BrCCCOC(CCOCCCOCCC(=O)OCCCBr)=O
Computed Properties
- Exact Mass: 460.00958
- Monoisotopic Mass: 460.00961g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 0
- Hydrogen Bond Acceptor Count: 6
- Heavy Atom Count: 23
- Rotatable Bond Count: 18
- Complexity: 274
- 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: 2.2
- Topological Polar Surface Area: 71.1?2
Experimental Properties
- PSA: 71.06
- LogP: 2.84630
Propanoic acid,3,3'-[1,3-propanediylbis(oxy)]bis-, bis(3-bromopropyl) ester (9CI) Related Literature
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Huading Zhang,Lee R. Moore,Maciej Zborowski,P. Stephen Williams,Shlomo Margel,Jeffrey J. Chalmers Analyst, 2005,130, 514-527
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Ana G. Neo,Ana Bornadiego,Jesús Díaz,Stefano Marcaccini,Carlos F. Marcos Org. Biomol. Chem., 2013,11, 6546-6555
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Fereshteh Bayat Environ. Sci.: Nano, 2021,8, 367-389
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Liao Xiaoqing,Li Ruiyi,Li Zaijun,Sun Xiulan,Wang Zhouping,Liu Junkang New J. Chem., 2015,39, 5240-5248
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Yaling Zhang,Chunhui Dai,Shiwei Zhou,Bin Liu Chem. Commun., 2018,54, 10092-10095
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