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851383-06-7 | 5(4H)-Oxazolone, 2-methyl-4-(4-morpholinylmethylene)-
CAS No: 851383-06-7 Catalog No: AG008G8B MDL No:
Product Description
Catalog Number:
AG008G8B
Chemical Name:
5(4H)-Oxazolone, 2-methyl-4-(4-morpholinylmethylene)-
CAS Number:
851383-06-7
Molecular Formula:
C9H12N2O3
Molecular Weight:
196.2032
IUPAC Name:
2-methyl-4-(morpholin-4-ylmethylidene)-1,3-oxazol-5-one
InChI:
InChI=1S/C9H12N2O3/c1-7-10-8(9(12)14-7)6-11-2-4-13-5-3-11/h6H,2-5H2,1H3
InChI Key:
GFSWBILASANGTQ-UHFFFAOYSA-N
SMILES:
O=C1OC(=NC1=CN1CCOCC1)C
Properties
Complexity:
303
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
196.085g/mol
Formal Charge:
0
Heavy Atom Count:
14
Hydrogen Bond Acceptor Count:
5
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
196.206g/mol
Monoisotopic Mass:
196.085g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
51.1A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
1
XLogP3:
-0.2
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