Cas no 105876-28-6 (Butanoic acid, 4-cyano-3-[[(1,1-dimethylethyl)dimethylsilyl]oxy]-, (R)-)
105876-28-6 structure
Product Name:Butanoic acid, 4-cyano-3-[[(1,1-dimethylethyl)dimethylsilyl]oxy]-, (R)-
CAS No:105876-28-6
MF:C11H21NO3Si
MW:243.374844312668
CID:1164912
PubChem ID:13732513
Update Time:2025-04-20
Butanoic acid, 4-cyano-3-[[(1,1-dimethylethyl)dimethylsilyl]oxy]-, (R)- Chemical and Physical Properties
Names and Identifiers
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- Butanoic acid, 4-cyano-3-[[(1,1-dimethylethyl)dimethylsilyl]oxy]-, (R)-
- 105876-28-6
- MDIRUHQVLPRTSX-SECBINFHSA-N
- (3R)-3-[tert-butyl(dimethyl)silyl]oxy-4-cyanobutanoic acid
- starbld0007593
- DB-247436
- (R)-4-cyano-3-[[(1,1-dimethylethyl)dimethylsilyl]oxy]butanoic acid
- SCHEMBL3981121
- (R)-3-((tert-Butyldimethylsilyl)oxy)-4-cyanobutanoic acid
- (R)-3-(tert-butyldimethylsilyloxy)-4-cyanobutanoic acid
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- Inchi: 1S/C11H21NO3Si/c1-11(2,3)16(4,5)15-9(6-7-12)8-10(13)14/h9H,6,8H2,1-5H3,(H,13,14)/t9-/m1/s1
- InChI Key: MDIRUHQVLPRTSX-SECBINFHSA-N
- SMILES: [Si](C)(C)(C(C)(C)C)O[C@H](CC#N)CC(=O)O
Computed Properties
- Exact Mass: 243.12907007g/mol
- Monoisotopic Mass: 243.12907007g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 1
- Hydrogen Bond Acceptor Count: 4
- Heavy Atom Count: 16
- Rotatable Bond Count: 6
- Complexity: 298
- Covalently-Bonded Unit Count: 1
- Defined Atom Stereocenter Count: 1
- Undefined Atom Stereocenter Count : 0
- Defined Bond Stereocenter Count: 0
- Undefined Bond Stereocenter Count: 0
- Topological Polar Surface Area: 70.3?2
Butanoic acid, 4-cyano-3-[[(1,1-dimethylethyl)dimethylsilyl]oxy]-, (R)- Related Literature
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Gloria Belén Ramírez-Rodríguez,José Manuel Delgado-López,Jaime Gómez-Morales CrystEngComm, 2013,15, 2206-2212
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Qiaoe Wang,Meiling Lian,Xiaowen Zhu,Xu Chen RSC Adv., 2021,11, 192-197
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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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Bin Han,Yasuo Shimizu,Gabriele Seguini,Celia Castro,Gérard Ben Assayag,Koji Inoue,Yasuyoshi Nagai,Sylvie Schamm-Chardon,Michele Perego RSC Adv., 2016,6, 3617-3622
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Nan Fu,Naphaporn Chiewchan,Xiao Dong Chen Food Funct., 2020,11, 211-220
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