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1197957-18-8 | Pyridine, 2-chloro-4-iodo-5-methyl-
CAS No: 1197957-18-8 Catalog No: AG000PNI MDL No:MFCD16610529
Product Description
Catalog Number:
AG000PNI
Chemical Name:
Pyridine, 2-chloro-4-iodo-5-methyl-
CAS Number:
1197957-18-8
Molecular Formula:
C6H5ClIN
Molecular Weight:
253.4681
MDL Number:
MFCD16610529
IUPAC Name:
2-chloro-4-iodo-5-methylpyridine
InChI:
InChI=1S/C6H5ClIN/c1-4-3-9-6(7)2-5(4)8/h2-3H,1H3
InChI Key:
ZWCNVOMJDJPZHE-UHFFFAOYSA-N
SMILES:
Clc1ncc(c(c1)I)C
Properties
Complexity:
99.1
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
252.916g/mol
Formal Charge:
0
Heavy Atom Count:
9
Hydrogen Bond Acceptor Count:
1
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
253.467g/mol
Monoisotopic Mass:
252.916g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
12.9A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.8
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