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Home > Bromides > 1214900-44-3
1214900-44-3 | 1H-Indazole, 6-bromo-1-(1-methylethyl)-
CAS No: 1214900-44-3 Catalog No: AG00152D MDL No:
Product Description
Catalog Number:
AG00152D
Chemical Name:
1H-Indazole, 6-bromo-1-(1-methylethyl)-
CAS Number:
1214900-44-3
Molecular Formula:
C10H11BrN2
Molecular Weight:
239.1117
IUPAC Name:
6-bromo-1-propan-2-ylindazole
InChI:
InChI=1S/C10H11BrN2/c1-7(2)13-10-5-9(11)4-3-8(10)6-12-13/h3-7H,1-2H3
InChI Key:
BGDRYWNOTNBYDJ-UHFFFAOYSA-N
SMILES:
Brc1ccc2c(c1)n(nc2)C(C)C
Properties
Complexity:
184
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
238.011g/mol
Formal Charge:
0
Heavy Atom Count:
13
Hydrogen Bond Acceptor Count:
1
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
239.116g/mol
Monoisotopic Mass:
238.011g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
17.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.5
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