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63016-85-3 | 2H-Pyrido[3,2-d][1,3]oxazine-2,4(1H)-dione(9CI)
CAS No: 63016-85-3 Catalog No: AG00EK1V MDL No:MFCD12913801
Product Description
Catalog Number:
AG00EK1V
Chemical Name:
2H-Pyrido[3,2-d][1,3]oxazine-2,4(1H)-dione(9CI)
CAS Number:
63016-85-3
Molecular Formula:
C7H4N2O3
Molecular Weight:
164.1183
MDL Number:
MFCD12913801
IUPAC Name:
1H-pyrido[3,2-d][1,3]oxazine-2,4-dione
InChI:
InChI=1S/C7H4N2O3/c10-6-5-4(2-1-3-8-5)9-7(11)12-6/h1-3H,(H,9,11)
InChI Key:
OINYTHCNBVUELD-UHFFFAOYSA-N
SMILES:
O=c1oc(=O)c2c([nH]1)cccn2
Properties
Complexity:
229
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
164.022g/mol
Formal Charge:
0
Heavy Atom Count:
12
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
164.12g/mol
Monoisotopic Mass:
164.022g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
68.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0.3
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