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1000577-87-6 | Acetic acid, 2-[(4-chloro-7-quinazolinyl)oxy]-, ethyl ester
CAS No: 1000577-87-6 Catalog No: AG0000RN MDL No:MFCD09878676
Product Description
Catalog Number:
AG0000RN
Chemical Name:
Acetic acid, 2-[(4-chloro-7-quinazolinyl)oxy]-, ethyl ester
CAS Number:
1000577-87-6
Molecular Formula:
C12H11ClN2O3
Molecular Weight:
266.6803
MDL Number:
MFCD09878676
IUPAC Name:
ethyl 2-(4-chloroquinazolin-7-yl)oxyacetate
InChI:
InChI=1S/C12H11ClN2O3/c1-2-17-11(16)6-18-8-3-4-9-10(5-8)14-7-15-12(9)13/h3-5,7H,2,6H2,1H3
InChI Key:
UGGIDCDRRBNSNV-UHFFFAOYSA-N
SMILES:
CCOC(=O)COc1ccc2c(c1)ncnc2Cl
Properties
Complexity:
291
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
266.046g/mol
Formal Charge:
0
Heavy Atom Count:
18
Hydrogen Bond Acceptor Count:
5
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
266.681g/mol
Monoisotopic Mass:
266.046g/mol
Rotatable Bond Count:
5
Topological Polar Surface Area:
61.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.8
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