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89539-53-7 | Pyrido[2,1-c][1,4]oxazine-3,8(1H,4H)-dione, 7-hydroxy-, hydrochloride
CAS No: 89539-53-7 Catalog No: AG003YPG MDL No:
Product Description
Catalog Number:
AG003YPG
Chemical Name:
Pyrido[2,1-c][1,4]oxazine-3,8(1H,4H)-dione, 7-hydroxy-, hydrochloride
CAS Number:
89539-53-7
Molecular Formula:
C8H8ClNO4
Molecular Weight:
217.6064
IUPAC Name:
7-hydroxy-1,4-dihydropyrido[2,1-c][1,4]oxazine-3,8-dione;hydrochloride
InChI:
InChI=1S/C8H7NO4.ClH/c10-6-1-5-4-13-8(12)3-9(5)2-7(6)11;/h1-2,11H,3-4H2;1H
InChI Key:
ALDJKFREPDROPU-UHFFFAOYSA-N
SMILES:
O=C1OCc2n(C1)cc(c(=O)c2)O.Cl
Properties
Complexity:
342
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
2
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
217.014g/mol
Formal Charge:
0
Heavy Atom Count:
14
Hydrogen Bond Acceptor Count:
5
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
217.605g/mol
Monoisotopic Mass:
217.014g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
66.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
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