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Home > Bromides > 1823346-15-1
1823346-15-1 | 2H-Indazole, 6-bromo-3-(methylthio)-
CAS No: 1823346-15-1 Catalog No: AG0023O9 MDL No:
Product Description
Catalog Number:
AG0023O9
Chemical Name:
2H-Indazole, 6-bromo-3-(methylthio)-
CAS Number:
1823346-15-1
Molecular Formula:
C8H7BrN2S
Molecular Weight:
243.1236
IUPAC Name:
6-bromo-3-methylsulfanyl-1H-indazole
InChI:
InChI=1S/C8H7BrN2S/c1-12-8-6-3-2-5(9)4-7(6)10-11-8/h2-4H,1H3,(H,10,11)
InChI Key:
MXXAXJIRPGZAPC-UHFFFAOYSA-N
SMILES:
CSc1[nH]nc2c1ccc(c2)Br
Properties
Complexity:
167
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
241.951g/mol
Formal Charge:
0
Heavy Atom Count:
12
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
243.122g/mol
Monoisotopic Mass:
241.951g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
54A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.1
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