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1137576-38-5 | Pyrimidine, 4,6-dichloro-5-iodo-
CAS No: 1137576-38-5 Catalog No: AG0009L2 MDL No:MFCD18072689
Product Description
Catalog Number:
AG0009L2
Chemical Name:
Pyrimidine, 4,6-dichloro-5-iodo-
CAS Number:
1137576-38-5
Molecular Formula:
C4HCl2IN2
Molecular Weight:
274.8746
MDL Number:
MFCD18072689
IUPAC Name:
4,6-dichloro-5-iodopyrimidine
InChI:
InChI=1S/C4HCl2IN2/c5-3-2(7)4(6)9-1-8-3/h1H
InChI Key:
YKSZLCOPANWXES-UHFFFAOYSA-N
SMILES:
Clc1ncnc(c1I)Cl
Properties
Complexity:
92.6
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
273.856g/mol
Formal Charge:
0
Heavy Atom Count:
9
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
274.87g/mol
Monoisotopic Mass:
273.856g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
25.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.8
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