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16353-27-8

16353-27-8 | 2,4(1H,3H)-Quinazolinedione, 6-iodo-

CAS No: 16353-27-8 Catalog No: AG001U79 MDL No:MFCD09029814

Product Description

Catalog Number:
AG001U79
Chemical Name:
2,4(1H,3H)-Quinazolinedione, 6-iodo-
CAS Number:
16353-27-8
Molecular Formula:
C8H5IN2O2
Molecular Weight:
288.0420
MDL Number:
MFCD09029814
IUPAC Name:
6-iodo-1H-quinazoline-2,4-dione
InChI:
InChI=1S/C8H5IN2O2/c9-4-1-2-6-5(3-4)7(12)11-8(13)10-6/h1-3H,(H2,10,11,12,13)
InChI Key:
NBSMJLABFCDYFQ-UHFFFAOYSA-N
SMILES:
Ic1ccc2c(c1)c(=O)[nH]c(=O)[nH]2

Properties

Complexity:
257  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
287.94g/mol
Formal Charge:
0
Heavy Atom Count:
13  
Hydrogen Bond Acceptor Count:
2  
Hydrogen Bond Donor Count:
2  
Isotope Atom Count:
0
Molecular Weight:
288.044g/mol
Monoisotopic Mass:
287.94g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
58.2A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0.8  

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