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1192004-62-8

1192004-62-8 | 1H-Indazole, 4-bromo-5-methoxy-

CAS No: 1192004-62-8 Catalog No: AG000IDC MDL No:MFCD17676852

Product Description

Catalog Number:
AG000IDC
Chemical Name:
1H-Indazole, 4-bromo-5-methoxy-
CAS Number:
1192004-62-8
Molecular Formula:
C8H7BrN2O
Molecular Weight:
227.0580
MDL Number:
MFCD17676852
IUPAC Name:
4-bromo-5-methoxy-1H-indazole
InChI:
InChI=1S/C8H7BrN2O/c1-12-7-3-2-6-5(8(7)9)4-10-11-6/h2-4H,1H3,(H,10,11)
InChI Key:
OJJMTCWSLYKVEH-UHFFFAOYSA-N
SMILES:
COc1ccc2c(c1Br)cn[nH]2

Properties

Complexity:
167  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
225.974g/mol
Formal Charge:
0
Heavy Atom Count:
12  
Hydrogen Bond Acceptor Count:
2  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
227.061g/mol
Monoisotopic Mass:
225.974g/mol
Rotatable Bond Count:
1  
Topological Polar Surface Area:
37.9A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.2  

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