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CAS Number: 89985-86-4
(R)-tert-butyl (1-hydroxybut-3-en-2-yl)carbamate

Structure

(R)-tert-butyl (1-hydroxybut-3-en-2-yl)carbamate
Name: (R)-tert-butyl (1-hydroxybut-3-en-2-yl)carbamate
Synonyms:
General Information
Product Number: 89985864
CAS Registry Number: 89985-86-4
Name:
        Carbamic acid, N-​[(1R)​-​1-​(hydroxymethyl)​-​2-​propen-​1-​yl]​-​, 1,​1-​dimethylethyl ester
        Carbamic acid, [(1R)​-​1-​(hydroxymethyl)​-​2-​propenyl]​-​, 1,​1-​dimethylethyl ester (9CI); Carbamic acid, [1-​(hydroxymethyl)​-​2-​propenyl]​-​, 1,​1-​dimethylethyl ester, (R)​-; tert-​Butyl [(1R)​-​1-​(hydroxymethyl)​prop-​2-​en-​1-​yl]​carbamate 
 
Chemical Formula: C9H17NO3
Exact Mass: 187.12
Molecular Weight: 187.24
m/z: 187.12 (100.0%), 188.12 (10.1%), 189.13 (1.1%)
Elemental Analysis: C, 57.73; H, 9.15; N, 7.48; O, 25.64
 
InChI: InChI=1S/C9H17NO3/c1-5-7(6-11)10-8(12)13-9(2,3)4/h5,7,11H,1,6H2,2-4H3,(H,10,12)/t7-/m1/s1
InChIKey: HYVYNSIWYIWTCK-SSDOTTSWSA-N
Canonical SMILES : CC(C)(C)OC(=O)NC(CO)C=C
Isomeric SMILES: CC(C)(C)OC(=O)N[C@@H](CO)C=C

Specification

98%

References

 

  1. (1) Daniels, R. Nathan; Journal of Organic Chemistry 2009, V74(22), P8852-8855 CAPLUS
  2. (2) Fernandez, Isabelle; Tetrahedron: Asymmetry 2006, V17(17), P2548-2557 CAPLUS
  3. (3) Trost, Barry M.; Angewandte Chemie, International Edition 2007, V46(32), P6123-6125, S6123/1-S6123/54 CAPLUS
  4. (4) JP 60056941 A 1985 CAPLUS
  5. (5) Spiegel, David A.; Journal of the American Chemical Society 2006, V128(46), P14766-14767 CAPLUS
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