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601516-17-0 | Pyrido[4,3-d]pyrimidine-6(5H)-carboxylic acid, 2-formyl-7,8-dihydro-,1,1-dimethylethyl ester
CAS No: 601516-17-0 Catalog No: AG01FOKY MDL No:
Product Description
Catalog Number:
AG01FOKY
Chemical Name:
Pyrido[4,3-d]pyrimidine-6(5H)-carboxylic acid, 2-formyl-7,8-dihydro-,1,1-dimethylethyl ester
CAS Number:
601516-17-0
IUPAC Name:
tert-butyl 2-formyl-7,8-dihydro-5H-pyrido[4,3-d]pyrimidine-6-carboxylate
InChI:
InChI=1S/C13H17N3O3/c1-13(2,3)19-12(18)16-5-4-10-9(7-16)6-14-11(8-17)15-10/h6,8H,4-5,7H2,1-3H3
InChI Key:
OKTZGXZEZXZTCO-UHFFFAOYSA-N
Properties
Complexity:
354
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
263.127g/mol
Formal Charge:
0
Heavy Atom Count:
19
Hydrogen Bond Acceptor Count:
5
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
263.297g/mol
Monoisotopic Mass:
263.127g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
72.4A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0.8
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