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860193-45-9

860193-45-9 | 5-IODOQUINAZOLIN-4(3H)-ONE

CAS No: 860193-45-9 Catalog No: AG00IDUW MDL No:MFCD09954850

Product Description

Catalog Number:
AG00IDUW
Chemical Name:
5-IODOQUINAZOLIN-4(3H)-ONE
CAS Number:
860193-45-9
Molecular Formula:
C8H5IN2O
Molecular Weight:
272.0426
MDL Number:
MFCD09954850
IUPAC Name:
5-iodo-3H-quinazolin-4-one
InChI:
InChI=1S/C8H5IN2O/c9-5-2-1-3-6-7(5)8(12)11-4-10-6/h1-4H,(H,10,11,12)
InChI Key:
NLTHTTIZUVYMQH-UHFFFAOYSA-N
SMILES:
Ic1cccc2c1c(O)ncn2

Properties

Complexity:
229  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
271.945g/mol
Formal Charge:
0
Heavy Atom Count:
12  
Hydrogen Bond Acceptor Count:
2  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
272.045g/mol
Monoisotopic Mass:
271.945g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
41.5A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.4  

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