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1445994-01-3 | 3(2H)-Pyridazinone, 4-amino-6-chloro-5-iodo-2-methyl-
CAS No: 1445994-01-3 Catalog No: AG001JTA MDL No:MFCD30179616
Product Description
Catalog Number:
AG001JTA
Chemical Name:
3(2H)-Pyridazinone, 4-amino-6-chloro-5-iodo-2-methyl-
CAS Number:
1445994-01-3
Molecular Formula:
C5H5ClIN3O
Molecular Weight:
285.4702
MDL Number:
MFCD30179616
IUPAC Name:
4-amino-6-chloro-5-iodo-2-methylpyridazin-3-one
InChI:
InChI=1S/C5H5ClIN3O/c1-10-5(11)3(8)2(7)4(6)9-10/h8H2,1H3
InChI Key:
FROPOZGDOUQHFW-UHFFFAOYSA-N
SMILES:
Clc1nn(C)c(=O)c(c1I)N
Properties
Complexity:
273
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
284.917g/mol
Formal Charge:
0
Heavy Atom Count:
11
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
285.469g/mol
Monoisotopic Mass:
284.917g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
58.7A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0.7
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