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147423-73-2 | 2-(bromomethyl)-6-chloro-3,4-dihydroquinazolin-4-one
CAS No: 147423-73-2 Catalog No: AG01ELSX MDL No:MFCD24071840
Product Description
Catalog Number:
AG01ELSX
Chemical Name:
2-(bromomethyl)-6-chloro-3,4-dihydroquinazolin-4-one
CAS Number:
147423-73-2
Molecular Formula:
C9H6BrClN2O
Molecular Weight:
273.5137
MDL Number:
MFCD24071840
IUPAC Name:
2-(bromomethyl)-6-chloro-6H-quinazolin-4-one
InChI:
InChI=1S/C9H6BrClN2O/c10-4-8-12-7-2-1-5(11)3-6(7)9(14)13-8/h1-3,5H,4H2
InChI Key:
LEFRKDIZNAMBEN-UHFFFAOYSA-N
SMILES:
BrCc1nc2ccc(cc2c(=O)[nH]1)Cl
Properties
Complexity:
409
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
271.935g/mol
Formal Charge:
0
Heavy Atom Count:
14
Hydrogen Bond Acceptor Count:
1
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
273.514g/mol
Monoisotopic Mass:
271.935g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
41.8A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
0
XLogP3:
1.7
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