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88724-12-3 | 1,5-Naphthyridine, 1,2-dihydro-6-methoxy-2,2,4-trimethyl-
CAS No: 88724-12-3 Catalog No: AG00453M MDL No:
Product Description
Catalog Number:
AG00453M
Chemical Name:
1,5-Naphthyridine, 1,2-dihydro-6-methoxy-2,2,4-trimethyl-
CAS Number:
88724-12-3
Molecular Formula:
C12H16N2O
Molecular Weight:
204.2682
IUPAC Name:
6-methoxy-2,2,4-trimethyl-1H-1,5-naphthyridine
InChI:
InChI=1S/C12H16N2O/c1-8-7-12(2,3)14-9-5-6-10(15-4)13-11(8)9/h5-7,14H,1-4H3
InChI Key:
ZDLMAZZHROBQQY-UHFFFAOYSA-N
SMILES:
COc1ccc2c(n1)C(=CC(N2)(C)C)C
Properties
Complexity:
273
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
204.126g/mol
Formal Charge:
0
Heavy Atom Count:
15
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
204.273g/mol
Monoisotopic Mass:
204.126g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
34.2A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2
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