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1072433-59-0 | 5-Iodo-1-methyl-1H-indazole
CAS No: 1072433-59-0 Catalog No: AG007ATS MDL No:MFCD11977535
Product Description
Catalog Number:
AG007ATS
Chemical Name:
5-Iodo-1-methyl-1H-indazole
CAS Number:
1072433-59-0
Molecular Formula:
C8H7IN2
Molecular Weight:
258.0590
MDL Number:
MFCD11977535
IUPAC Name:
5-iodo-1-methylindazole
InChI:
InChI=1S/C8H7IN2/c1-11-8-3-2-7(9)4-6(8)5-10-11/h2-5H,1H3
InChI Key:
SGYVAWASNYRGPR-UHFFFAOYSA-N
SMILES:
Ic1ccc2c(c1)cnn2C
Properties
Complexity:
151
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
257.965g/mol
Formal Charge:
0
Heavy Atom Count:
11
Hydrogen Bond Acceptor Count:
1
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
258.062g/mol
Monoisotopic Mass:
257.965g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
17.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.2
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