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Home > Bromides > 1310705-15-7
1310705-15-7 | 1H-Indazole, 3-bromo-5-methoxy-1-methyl-
CAS No: 1310705-15-7 Catalog No: AG000VH0 MDL No:
Product Description
Catalog Number:
AG000VH0
Chemical Name:
1H-Indazole, 3-bromo-5-methoxy-1-methyl-
CAS Number:
1310705-15-7
Molecular Formula:
C9H9BrN2O
Molecular Weight:
241.0846
IUPAC Name:
3-bromo-5-methoxy-1-methylindazole
InChI:
InChI=1S/C9H9BrN2O/c1-12-8-4-3-6(13-2)5-7(8)9(10)11-12/h3-5H,1-2H3
InChI Key:
GAACIBBQJSMZMD-UHFFFAOYSA-N
SMILES:
COc1ccc2c(c1)c(Br)nn2C
Properties
Complexity:
191
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
239.99g/mol
Formal Charge:
0
Heavy Atom Count:
13
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
241.088g/mol
Monoisotopic Mass:
239.99g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
27A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.6
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