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Home > Bromides > 1197943-62-6
1197943-62-6 | 1H-Indazole, 5-bromo-3-propyl-
CAS No: 1197943-62-6 Catalog No: AG000PMV MDL No:MFCD19684136
Product Description
Catalog Number:
AG000PMV
Chemical Name:
1H-Indazole, 5-bromo-3-propyl-
CAS Number:
1197943-62-6
Molecular Formula:
C10H11BrN2
Molecular Weight:
239.1117
MDL Number:
MFCD19684136
IUPAC Name:
5-bromo-3-propyl-2H-indazole
InChI:
InChI=1S/C10H11BrN2/c1-2-3-9-8-6-7(11)4-5-10(8)13-12-9/h4-6H,2-3H2,1H3,(H,12,13)
InChI Key:
JLJODUUBUCVUKP-UHFFFAOYSA-N
SMILES:
CCCc1n[nH]c2c1cc(Br)cc2
Properties
Complexity:
174
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:
1
Isotope Atom Count:
0
Molecular Weight:
239.116g/mol
Monoisotopic Mass:
238.011g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
28.7A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.4
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