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6-(acetyloxy)-4-chloroquinazolin-7-yl acetate

6-(acetyloxy)-4-chloroquinazolin-7-yl acetate

CAS: 938185-04-7

Formula: C12H9ClN2O4

SMILES: CC(=O)OC1=CC2=NC=NC(Cl)=C2C=C1OC(C)=O

IUPAC: 6-(acetyloxy)-4-chloroquinazolin-7-yl acetate

InChI: InChI=1S/C12H9ClN2O4/c1-6(16)18-10-3-8-9(14-5-15-12(8)13)4-11(10)19-7(2)17/h3-5H,1-2H3

Composition: C (51.35%), H (3.23%), Cl (12.63%), N (9.98%), O (22.80%)

Molar Mass: 280.66

Atom Count: 28

Heavy Atom Count: 19

Properties
Properties
Common Names N/A
Aromatic Ring Count 2
Asymmetric Atom Count 0
Exact Mass 280.0250845
Formal Charge 0
FSP3 0.17
Hetero Ring Count 1
Hydrogen Bond Acceptor Count 4
Hydrogen Bond Donor Count 0
InChIKey ZUFINQJTXMSFEP-UHFFFAOYSA-N
Lipinski's Rule of Five 1
Molar Refractivity 66.93
Topological Polar Surface Area 78.38
Polarizability 26.91
Ring Count 2
Rotatable Bond Count 4

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97% <7 Days 938185-04-7 $269.28-$1,815.77$269.28$568.48$1,815.77
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