Cas no 77744-45-7 (Heptanoic acid,7-[[(1,1-dimethylethyl)dimethylsilyl]oxy]-)
77744-45-7 structure
Product Name:Heptanoic acid,7-[[(1,1-dimethylethyl)dimethylsilyl]oxy]-
CAS No:77744-45-7
MF:C13H28O3Si
MW:260.445125579834
CID:550695
PubChem ID:554796
Update Time:2025-04-19
Heptanoic acid,7-[[(1,1-dimethylethyl)dimethylsilyl]oxy]- Chemical and Physical Properties
Names and Identifiers
-
- Heptanoic acid,7-[[(1,1-dimethylethyl)dimethylsilyl]oxy]-
- 7-[(tert-Butyldimethylsilyl)oxy]heptanoicacid
- Heptanoic acid, 7-t-butyldimethylsilyloxy-
- DTXSID501016318
- SCHEMBL1930904
- 7-([tert-Butyl(dimethyl)silyl]oxy)heptanoic acid #
- 77744-45-7
- OHJGUCCYCNBSIL-UHFFFAOYSA-N
-
- Inchi: 1S/C13H28O3Si/c1-13(2,3)17(4,5)16-11-9-7-6-8-10-12(14)15/h6-11H2,1-5H3,(H,14,15)
- InChI Key: OHJGUCCYCNBSIL-UHFFFAOYSA-N
- SMILES: [Si](C)(C)(C(C)(C)C)OCCCCCCC(=O)O
Computed Properties
- Exact Mass: 260.18084
- Monoisotopic Mass: 260.18077129g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 1
- Hydrogen Bond Acceptor Count: 3
- Heavy Atom Count: 17
- Rotatable Bond Count: 9
- Complexity: 231
- 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
- Topological Polar Surface Area: 46.5?2
Experimental Properties
- PSA: 46.53
Heptanoic acid,7-[[(1,1-dimethylethyl)dimethylsilyl]oxy]- Related Literature
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M. Zeiger,N. J?ckel,P. Strubel,L. Borchardt,R. Reinhold,W. Nickel,J. Eckert,V. Presser,S. Kaskel J. Mater. Chem. A, 2015,3, 17983-17990
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Eric Besson,Stéphane Gastaldi,Emily Bloch,Selma Aslan,Hakim Karoui,Olivier Ouari,Micael Hardy Analyst, 2019,144, 4194-4203
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Chen-Yu Chien,Sheng-Sheng Yu Chem. Commun., 2020,56, 11949-11952
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