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1159812-67-5

1159812-67-5 | 2-Quinazolineacetic acid, 7-bromo-, ethyl ester

CAS No: 1159812-67-5 Catalog No: AG000H9P MDL No:

Product Description

Catalog Number:
AG000H9P
Chemical Name:
2-Quinazolineacetic acid, 7-bromo-, ethyl ester
CAS Number:
1159812-67-5
Molecular Formula:
C12H11BrN2O2
Molecular Weight:
295.1319
IUPAC Name:
ethyl 2-(7-bromoquinazolin-2-yl)acetate
InChI:
InChI=1S/C12H11BrN2O2/c1-2-17-12(16)6-11-14-7-8-3-4-9(13)5-10(8)15-11/h3-5,7H,2,6H2,1H3
InChI Key:
UKUCBGDIWAYPMZ-UHFFFAOYSA-N
SMILES:
CCOC(=O)Cc1ncc2c(n1)cc(cc2)Br

Properties

Complexity:
275  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
294g/mol
Formal Charge:
0
Heavy Atom Count:
17  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
295.136g/mol
Monoisotopic Mass:
294g/mol
Rotatable Bond Count:
4  
Topological Polar Surface Area:
52.1A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.4  

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