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1626-11-5 | 4H-1,3-Dioxino[4,5-c]pyridine-5-carboxamide, 2,2,8-trimethyl-
CAS No: 1626-11-5 Catalog No: AG001T9R MDL No:
Product Description
Catalog Number:
AG001T9R
Chemical Name:
4H-1,3-Dioxino[4,5-c]pyridine-5-carboxamide, 2,2,8-trimethyl-
CAS Number:
1626-11-5
Molecular Formula:
C11H14N2O3
Molecular Weight:
222.2405
IUPAC Name:
2,2,8-trimethyl-4H-[1,3]dioxino[4,5-c]pyridine-5-carboxamide
InChI:
InChI=1S/C11H14N2O3/c1-6-9-8(5-15-11(2,3)16-9)7(4-13-6)10(12)14/h4H,5H2,1-3H3,(H2,12,14)
InChI Key:
LDGLRYBNWJPSMZ-UHFFFAOYSA-N
SMILES:
Cc1ncc(c2c1OC(C)(C)OC2)C(=O)N
UNII:
8SBH28IDC9
NSC Number:
103696
Properties
Complexity:
293
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
222.1g/mol
Formal Charge:
0
Heavy Atom Count:
16
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
222.244g/mol
Monoisotopic Mass:
222.1g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
74.4A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0.2
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