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Home > Bromides > 1666113-01-4
1666113-01-4 | Quinazoline, 8-bromo-4-methyl-
CAS No: 1666113-01-4 Catalog No: AG001WUW MDL No:MFCD26954822
Product Description
Catalog Number:
AG001WUW
Chemical Name:
Quinazoline, 8-bromo-4-methyl-
CAS Number:
1666113-01-4
Molecular Formula:
C9H7BrN2
Molecular Weight:
223.0693
MDL Number:
MFCD26954822
IUPAC Name:
8-bromo-4-methylquinazoline
InChI:
InChI=1S/C9H7BrN2/c1-6-7-3-2-4-8(10)9(7)12-5-11-6/h2-5H,1H3
InChI Key:
TXSASISPKDGBPU-UHFFFAOYSA-N
SMILES:
Brc1cccc2c1ncnc2C
Properties
Complexity:
163
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
221.979g/mol
Formal Charge:
0
Heavy Atom Count:
12
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
223.073g/mol
Monoisotopic Mass:
221.979g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
25.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.6
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