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1803603-93-1 | tert-butyl N-(3-carbamoyl-1,2-oxazol-5-yl)carbamate
CAS No: 1803603-93-1 Catalog No: AG01B9KJ MDL No:MFCD28397404
Product Description
Catalog Number:
AG01B9KJ
Chemical Name:
tert-butyl N-(3-carbamoyl-1,2-oxazol-5-yl)carbamate
CAS Number:
1803603-93-1
Molecular Formula:
C9H13N3O4
Molecular Weight:
227.2172
MDL Number:
MFCD28397404
IUPAC Name:
tert-butyl N-(3-carbamoyl-1,2-oxazol-5-yl)carbamate
InChI:
InChI=1S/C9H13N3O4/c1-9(2,3)15-8(14)11-6-4-5(7(10)13)12-16-6/h4H,1-3H3,(H2,10,13)(H,11,14)
InChI Key:
JDWGIYVFHLDBBV-UHFFFAOYSA-N
SMILES:
O=C(Nc1onc(c1)C(=O)N)OC(C)(C)C
Properties
Complexity:
287
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
227.091g/mol
Formal Charge:
0
Heavy Atom Count:
16
Hydrogen Bond Acceptor Count:
5
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
227.22g/mol
Monoisotopic Mass:
227.091g/mol
Rotatable Bond Count:
4
Topological Polar Surface Area:
107A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0.5
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