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Home > Bromides > 1159511-76-8
1159511-76-8 | 1H-Indazole, 4-bromo-1,3-dimethyl-
CAS No: 1159511-76-8 Catalog No: AG000H66 MDL No:MFCD12028619
Product Description
Catalog Number:
AG000H66
Chemical Name:
1H-Indazole, 4-bromo-1,3-dimethyl-
CAS Number:
1159511-76-8
Molecular Formula:
C9H9BrN2
Molecular Weight:
225.0852
MDL Number:
MFCD12028619
IUPAC Name:
4-bromo-1,3-dimethylindazole
InChI:
InChI=1S/C9H9BrN2/c1-6-9-7(10)4-3-5-8(9)12(2)11-6/h3-5H,1-2H3
InChI Key:
UYDBSDZCDWTRGM-UHFFFAOYSA-N
SMILES:
Brc1cccc2c1c(C)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:
223.995g/mol
Formal Charge:
0
Heavy Atom Count:
12
Hydrogen Bond Acceptor Count:
1
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
225.089g/mol
Monoisotopic Mass:
223.995g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
17.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.7
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