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25392-50-1 | Oxazorone
CAS No: 25392-50-1 Catalog No: AG00C3TG MDL No:MFCD00868668
Product Description
Catalog Number:
AG00C3TG
Chemical Name:
Oxazorone
CAS Number:
25392-50-1
Molecular Formula:
C14H15NO4
Molecular Weight:
261.2732
MDL Number:
MFCD00868668
IUPAC Name:
7-hydroxy-4-(morpholin-4-ylmethyl)chromen-2-one
InChI:
InChI=1S/C14H15NO4/c16-11-1-2-12-10(7-14(17)19-13(12)8-11)9-15-3-5-18-6-4-15/h1-2,7-8,16H,3-6,9H2
InChI Key:
LLQWUZKGZZNBKG-UHFFFAOYSA-N
SMILES:
Oc1ccc2c(c1)oc(=O)cc2CN1CCOCC1
UNII:
77243B845F
Properties
Complexity:
376
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
261.1g/mol
Formal Charge:
0
Heavy Atom Count:
19
Hydrogen Bond Acceptor Count:
5
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
261.277g/mol
Monoisotopic Mass:
261.1g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
59A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1
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