Cas no 106539-14-4 (Butanoic acid,3-[[(1,1-dimethylethoxy)carbonyl]amino]-, methyl ester, (3S)-)
![Butanoic acid,3-[[(1,1-dimethylethoxy)carbonyl]amino]-, methyl ester, (3S)- structure](https://ossimg.kuujia.com/scimg/107000/106539-14-4x500.png)
106539-14-4 structure
Product Name:Butanoic acid,3-[[(1,1-dimethylethoxy)carbonyl]amino]-, methyl ester, (3S)-
CAS No:106539-14-4
MF:C10H19NO4
MW:217.26216340065
CID:127200
PubChem ID:11218213
Update Time:2025-04-18
Butanoic acid,3-[[(1,1-dimethylethoxy)carbonyl]amino]-, methyl ester, (3S)- Chemical and Physical Properties
Names and Identifiers
-
- Butanoic acid,3-[[(1,1-dimethylethoxy)carbonyl]amino]-, methyl ester, (3S)-
- (S)-methyl 3-(tert-butoxycarbonyl)butanoate
- methyl (3S)-3-[(2-methylpropan-2-yl)oxycarbonylamino]butanoate
- METHYL (S)-3-BOC-AMINOBUTYRATE
- (S)-3-tert-butoxycarbonylamino-butyric acid methyl ester
- (S)-methyl 3-(tert-butyloxycarbonylamino)butyrate
- Boc-hAla methyl ester
- M30110
- methyl (3S)-3-[(tert-butoxycarbonyl)amino]butanoate
- SUHJJLDEYCLBFT-ZETCQYMHSA-N
- SCHEMBL1369011
- Methyl(S)-3-boc-aminobutyrate
- 106539-14-4
- DTXSID10459085
- (S)-methyl 3-((tert-butoxycarbonyl)amino)butanoate
- Zinc04202785
-
- Inchi： 1S/C10H19NO4/c1-7(6-8(12)14-5)11-9(13)15-10(2,3)4/h7H,6H2,1-5H3,(H,11,13)/t7-/m0/s1
- InChI Key： SUHJJLDEYCLBFT-ZETCQYMHSA-N
- SMILES： O(C(N[C@@H](C)CC(=O)OC)=O)C(C)(C)C
Computed Properties
- Exact Mass: 217.13147
- Monoisotopic Mass: 217.13140809g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 0
- Hydrogen Bond Acceptor Count: 4
- Heavy Atom Count: 14
- Rotatable Bond Count: 6
- Complexity: 232
- 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
- XLogP3: 1.2
- Topological Polar Surface Area: 64.6?2
Experimental Properties
- Density: 1.035
- Boiling Point: 302.8°Cat760mmHg
- Flash Point: 136.9°C
- Refractive Index: 1.441
- PSA: 64.63
- LogP: 1.66710
Butanoic acid,3-[[(1,1-dimethylethoxy)carbonyl]amino]-, methyl ester, (3S)- Related Literature
-
Tengfei Yu,Yuehan Wu,Wei Li,Bin Li RSC Adv., 2014,4, 34134-34143
-
Byungho Lim,Jaewon Jin,Jin Yoo,Seung Yong Han,Kyeongyeol Kim,Sungah Kang,Nojin Park,Sang Moon Lee,Hae Jin Kim,Seung Uk Son Chem. Commun., 2014,50, 7723-7726
-
Riccardo Spezia,Stefan Knecht,Benedetta Mennucci Phys. Chem. Chem. Phys., 2017,19, 17156-17166
-
Ross Harder,David C. Dunand,Ian McNulty Nanoscale, 2017,9, 5686-5693
106539-14-4 (Butanoic acid,3-[[(1,1-dimethylethoxy)carbonyl]amino]-, methyl ester, (3S)-) Related Products
- 158851-30-0((3S)-3-(tert-butoxycarbonylamino)butanoic acid)
- 52815-19-7(Boc-dl-3-aminobutyric acid)
- 129765-95-3(3-{[(tert-butoxy)carbonyl]amino}-3-methylbutanoic acid)
- 132549-43-0(Boc-L-beta-Homoleucine)
- 749208-35-3(Boc-D-beta-Homoserine)
- 83345-44-2(Boc-HoSer-OH)
- 159991-23-8((R)-3-(tert-Butoxycarbonylamino)butanoic Acid)
- 215789-45-0(trans-2-4-(tert-Butoxycarbonyl)aminocyclohexylacetic Acid Methyl Ester)
- 159877-47-1(Methyl (R)-N-boc-3-aminobutyrate)
- 2098070-20-1(2-(3-(Pyridin-3-yl)-1H-pyrazol-1-yl)acetimidamide)
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