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1174064-60-8 | Ethanone, 1-(5-iodo-2H-indazol-2-yl)-
CAS No: 1174064-60-8 Catalog No: AG000E8W MDL No:MFCD11520128
Product Description
Catalog Number:
AG000E8W
Chemical Name:
Ethanone, 1-(5-iodo-2H-indazol-2-yl)-
CAS Number:
1174064-60-8
Molecular Formula:
C9H7IN2O
Molecular Weight:
286.0691
MDL Number:
MFCD11520128
IUPAC Name:
1-(5-iodoindazol-2-yl)ethanone
InChI:
InChI=1S/C9H7IN2O/c1-6(13)12-5-7-4-8(10)2-3-9(7)11-12/h2-5H,1H3
InChI Key:
JXZRYFOLDPVLCP-UHFFFAOYSA-N
SMILES:
Ic1ccc2c(c1)cn(n2)C(=O)C
Properties
Complexity:
222
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
285.96g/mol
Formal Charge:
0
Heavy Atom Count:
13
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
286.072g/mol
Monoisotopic Mass:
285.96g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
34.9A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.1
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