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Home > Pyridines > 1258652-32-2
1258652-32-2 | 4-ethoxy-5H,6H,7H,8H-pyrido[4,3-d]pyrimidine
CAS No: 1258652-32-2 Catalog No: AG01A8Y1 MDL No:MFCD17976976
Product Description
Catalog Number:
AG01A8Y1
Chemical Name:
4-ethoxy-5H,6H,7H,8H-pyrido[4,3-d]pyrimidine
CAS Number:
1258652-32-2
Molecular Formula:
C9H13N3O
Molecular Weight:
179.2190
MDL Number:
MFCD17976976
IUPAC Name:
4-ethoxy-5,6,7,8-tetrahydropyrido[4,3-d]pyrimidine
InChI:
InChI=1S/C9H13N3O/c1-2-13-9-7-5-10-4-3-8(7)11-6-12-9/h6,10H,2-5H2,1H3
InChI Key:
VROMRJBUZCYJBV-UHFFFAOYSA-N
SMILES:
CCOc1ncnc2c1CNCC2
Properties
Complexity:
165
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
179.106g/mol
Formal Charge:
0
Heavy Atom Count:
13
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
179.223g/mol
Monoisotopic Mass:
179.106g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
47A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0.3
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