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1159511-22-4

1159511-22-4 | Ethanone, 1-(1H-indazol-7-yl)-

CAS No: 1159511-22-4 Catalog No: AG000H6M MDL No:MFCD11869765

Product Description

Catalog Number:
AG000H6M
Chemical Name:
Ethanone, 1-(1H-indazol-7-yl)-
CAS Number:
1159511-22-4
Molecular Formula:
C9H8N2O
Molecular Weight:
160.1726
MDL Number:
MFCD11869765
IUPAC Name:
1-(1H-indazol-7-yl)ethanone
InChI:
InChI=1S/C9H8N2O/c1-6(12)8-4-2-3-7-5-10-11-9(7)8/h2-5H,1H3,(H,10,11)
InChI Key:
BTLVDERQIQFTRL-UHFFFAOYSA-N
SMILES:
CC(=O)c1cccc2c1[nH]nc2

Properties

Complexity:
193  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
160.064g/mol
Formal Charge:
0
Heavy Atom Count:
12  
Hydrogen Bond Acceptor Count:
2  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
160.176g/mol
Monoisotopic Mass:
160.064g/mol
Rotatable Bond Count:
1  
Topological Polar Surface Area:
45.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.2  

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