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672310-07-5 | TERT-BUTYL (S)-1-(4-(ETHOXYCARBONYL)OXAZOL-5-YL)ETHYLCARBAMATE
CAS No: 672310-07-5 Catalog No: AG00FAFT MDL No:MFCD09025770
Product Description
Catalog Number:
AG00FAFT
Chemical Name:
TERT-BUTYL (S)-1-(4-(ETHOXYCARBONYL)OXAZOL-5-YL)ETHYLCARBAMATE
CAS Number:
672310-07-5
Molecular Formula:
C13H20N2O5
Molecular Weight:
284.3083
MDL Number:
MFCD09025770
IUPAC Name:
ethyl 5-[(1S)-1-[(2-methylpropan-2-yl)oxycarbonylamino]ethyl]-1,3-oxazole-4-carboxylate
InChI:
InChI=1S/C13H20N2O5/c1-6-18-11(16)9-10(19-7-14-9)8(2)15-12(17)20-13(3,4)5/h7-8H,6H2,1-5H3,(H,15,17)/t8-/m0/s1
InChI Key:
XWMGDDWCHXFLSM-QMMMGPOBSA-N
SMILES:
CCOC(=O)c1ncoc1[C@@H](NC(=O)OC(C)(C)C)C
Properties
Complexity:
353
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
1
Defined Bond Stereocenter Count:
0
Exact Mass:
284.137g/mol
Formal Charge:
0
Heavy Atom Count:
20
Hydrogen Bond Acceptor Count:
6
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
284.312g/mol
Monoisotopic Mass:
284.137g/mol
Rotatable Bond Count:
7
Topological Polar Surface Area:
90.7A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.8
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