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Home > Bromides > 1269292-50-3
1269292-50-3 | 1H-Pyrazole, 1-(2-bromophenyl)-5-(2-thienyl)-
CAS No: 1269292-50-3 Catalog No: AG000TJ9 MDL No:MFCD20275423
Product Description
Catalog Number:
AG000TJ9
Chemical Name:
1H-Pyrazole, 1-(2-bromophenyl)-5-(2-thienyl)-
CAS Number:
1269292-50-3
Molecular Formula:
C13H9BrN2S
Molecular Weight:
305.1930
MDL Number:
MFCD20275423
IUPAC Name:
1-(2-bromophenyl)-5-thiophen-2-ylpyrazole
InChI:
InChI=1S/C13H9BrN2S/c14-10-4-1-2-5-11(10)16-12(7-8-15-16)13-6-3-9-17-13/h1-9H
InChI Key:
DAFNZKJXNKZTCB-UHFFFAOYSA-N
SMILES:
Brc1ccccc1n1nccc1c1cccs1
Properties
Complexity:
264
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
303.967g/mol
Formal Charge:
0
Heavy Atom Count:
17
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
305.193g/mol
Monoisotopic Mass:
303.967g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
46.1A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
4
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