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89539-52-6 | Pyrido[2,1-c][1,4]oxazine-3,8(1H,4H)-dione, 7-(phenylmethoxy)-
CAS No: 89539-52-6 Catalog No: AG0040JO MDL No:
Product Description
Catalog Number:
AG0040JO
Chemical Name:
Pyrido[2,1-c][1,4]oxazine-3,8(1H,4H)-dione, 7-(phenylmethoxy)-
CAS Number:
89539-52-6
Molecular Formula:
C15H13NO4
Molecular Weight:
271.2680
IUPAC Name:
7-phenylmethoxy-1,4-dihydropyrido[2,1-c][1,4]oxazine-3,8-dione
InChI:
InChI=1S/C15H13NO4/c17-13-6-12-10-20-15(18)8-16(12)7-14(13)19-9-11-4-2-1-3-5-11/h1-7H,8-10H2
InChI Key:
AUTJEWOGSWWZQY-UHFFFAOYSA-N
SMILES:
O=C1OCc2n(C1)cc(c(=O)c2)OCc1ccccc1
Properties
Complexity:
474
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
271.084g/mol
Formal Charge:
0
Heavy Atom Count:
20
Hydrogen Bond Acceptor Count:
5
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
271.272g/mol
Monoisotopic Mass:
271.084g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
55.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.5
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