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Home > Bromides > 1269292-35-4
1269292-35-4 | Thiazole, 2-[1-(4-bromophenyl)-1H-pyrazol-5-yl]-
CAS No: 1269292-35-4 Catalog No: AG000TJJ MDL No:MFCD20275436
Product Description
Catalog Number:
AG000TJJ
Chemical Name:
Thiazole, 2-[1-(4-bromophenyl)-1H-pyrazol-5-yl]-
CAS Number:
1269292-35-4
Molecular Formula:
C12H8BrN3S
Molecular Weight:
306.1810
MDL Number:
MFCD20275436
IUPAC Name:
2-[2-(4-bromophenyl)pyrazol-3-yl]-1,3-thiazole
InChI:
InChI=1S/C12H8BrN3S/c13-9-1-3-10(4-2-9)16-11(5-6-15-16)12-14-7-8-17-12/h1-8H
InChI Key:
BSSDJVWXULJZFJ-UHFFFAOYSA-N
SMILES:
Brc1ccc(cc1)n1nccc1c1nccs1
Properties
Complexity:
258
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
304.962g/mol
Formal Charge:
0
Heavy Atom Count:
17
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
306.181g/mol
Monoisotopic Mass:
304.962g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
59A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.3
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