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1803581-24-9 | tert-butyl N-[(3-carbamoyl-4,5-dihydro-1,2-oxazol-5-yl)methyl]carbamate
CAS No: 1803581-24-9 Catalog No: AG01AFOX MDL No:MFCD27959361
Product Description
Catalog Number:
AG01AFOX
Chemical Name:
tert-butyl N-[(3-carbamoyl-4,5-dihydro-1,2-oxazol-5-yl)methyl]carbamate
CAS Number:
1803581-24-9
Molecular Formula:
C10H17N3O4
Molecular Weight:
243.2597
MDL Number:
MFCD27959361
IUPAC Name:
tert-butyl N-[(3-carbamoyl-4,5-dihydro-1,2-oxazol-5-yl)methyl]carbamate
InChI:
InChI=1S/C10H17N3O4/c1-10(2,3)16-9(15)12-5-6-4-7(8(11)14)13-17-6/h6H,4-5H2,1-3H3,(H2,11,14)(H,12,15)
InChI Key:
FYUOJDFLGWIECB-UHFFFAOYSA-N
SMILES:
O=C(OC(C)(C)C)NCC1ON=C(C1)C(=O)N
Properties
Complexity:
346
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
243.122g/mol
Formal Charge:
0
Heavy Atom Count:
17
Hydrogen Bond Acceptor Count:
5
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
243.263g/mol
Monoisotopic Mass:
243.122g/mol
Rotatable Bond Count:
5
Topological Polar Surface Area:
103A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
0
XLogP3:
-0.1
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