2-Amino-7,7-dimethyl-7,8-dihydroquinazolin-5(6H)-one - CAS 21599-37-1
Catalog: |
BB046929 |
Product Name: |
2-Amino-7,7-dimethyl-7,8-dihydroquinazolin-5(6H)-one |
CAS: |
21599-37-1 |
Synonyms: |
2-Amino-7,7-dimethyl-7,8-dihydro-6H-quinazolin-5-one; 2-amino-7,7-dimethyl-7,8-dihydro-5(6H)-quinazolinone; 5(6H)-Quinazolinone, 2-amino-7,8-dihydro-7,7-dimethyl-; 2-amino-7,7-dimethyl-6,7,8-trihydroquinazolin-5-one; 2-amino-7,7-dimethyl-5-oxo-5,6,7,8-tetrahydroquinazoline |
IUPAC Name: | 2-amino-7,7-dimethyl-6,8-dihydroquinazolin-5-one |
Description: | 2-Amino-7,7-dimethyl-7,8-dihydroquinazolin-5(6H)-one (CAS# 21599-37-1 ) is a useful research chemical. |
Molecular Weight: | 191.23 |
Molecular Formula: | C10H13N3O |
Canonical SMILES: | CC1(CC2=NC(=NC=C2C(=O)C1)N)C |
InChI: | InChI=1S/C10H13N3O/c1-10(2)3-7-6(8(14)4-10)5-12-9(11)13-7/h5H,3-4H2,1-2H3,(H2,11,12,13) |
InChI Key: | IVSMYCAEYJVVAD-UHFFFAOYSA-N |
Boiling Point: | 394.3±45.0 °C (Predicted) |
Melting Point: | 240-241 °C |
Purity: | ≥ 95 % |
Density: | 1.195±0.06 g/cm3 (Predicted) |
Complexity: | 252 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 191.105862047 |
Formal Charge: | 0 |
Heavy Atom Count: | 14 |
Hydrogen Bond Acceptor Count: | 4 |
Hydrogen Bond Donor Count: | 1 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 191.105862047 |
Rotatable Bond Count: | 0 |
Topological Polar Surface Area: | 68.9 |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | 0.8 |
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