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1060817-19-7 | 3-iodo-1,4-dimethyl-1H-indazole
CAS No: 1060817-19-7 Catalog No: AG00J1U6 MDL No:MFCD11053932
Product Description
Catalog Number:
AG00J1U6
Chemical Name:
3-iodo-1,4-dimethyl-1H-indazole
CAS Number:
1060817-19-7
Molecular Formula:
C9H9IN2
Molecular Weight:
272.0856
MDL Number:
MFCD11053932
IUPAC Name:
3-iodo-1,4-dimethylindazole
InChI:
InChI=1S/C9H9IN2/c1-6-4-3-5-7-8(6)9(10)11-12(7)2/h3-5H,1-2H3
InChI Key:
MKEPETVCLUSGRK-UHFFFAOYSA-N
SMILES:
Cc1cccc2c1c(I)nn2C
Properties
Complexity:
174
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
271.981g/mol
Formal Charge:
0
Heavy Atom Count:
12
Hydrogen Bond Acceptor Count:
1
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
272.089g/mol
Monoisotopic Mass:
271.981g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
17.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.6
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