4-ethoxy-5H,6H,7H,8H-pyrido[4,3-d]pyrimidine - CAS 1258652-32-2
Catalog: |
BB055998 |
Product Name: |
4-ethoxy-5H,6H,7H,8H-pyrido[4,3-d]pyrimidine |
CAS: |
1258652-32-2 |
Synonyms: |
4-ethoxy-5H,6H,7H,8H-pyrido[4,3-d]pyrimidine; 4-ethoxy-5,6,7,8-tetrahydropyrido[4,3-d]pyrimidine |
IUPAC Name: | 4-ethoxy-5,6,7,8-tetrahydropyrido[4,3-d]pyrimidine |
Description: | 4-ethoxy-5H,6H,7H,8H-pyrido[4,3-d]pyrimidine (cas# 1258652-32-2) is a useful research chemical. |
Molecular Weight: | 179.21 |
Molecular Formula: | C9H13N3O |
Canonical SMILES: | CCOC1=NC=NC2=C1CNCC2 |
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 |
Complexity: | 165 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 179.105862047 |
Formal Charge: | 0 |
Heavy Atom Count: | 13 |
Hydrogen Bond Acceptor Count: | 4 |
Hydrogen Bond Donor Count: | 1 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 179.105862047 |
Rotatable Bond Count: | 2 |
Topological Polar Surface Area: | 47Ų |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | 0.3 |
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