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Home > Bromides > 1423706-23-3
1423706-23-3 | 1-(4-Bromophenyl)-1H-imidazole-5-carboxylic acid
CAS No: 1423706-23-3 Catalog No: AG01ETTG MDL No:
Product Description
Catalog Number:
AG01ETTG
Chemical Name:
1-(4-Bromophenyl)-1H-imidazole-5-carboxylic acid
CAS Number:
1423706-23-3
Molecular Formula:
C10H7BrN2O2
Molecular Weight:
267.0788
IUPAC Name:
3-(4-bromophenyl)imidazole-4-carboxylic acid
InChI:
InChI=1S/C10H7BrN2O2/c11-7-1-3-8(4-2-7)13-6-12-5-9(13)10(14)15/h1-6H,(H,14,15)
InChI Key:
FNNYTZBNNMMZEU-UHFFFAOYSA-N
SMILES:
Brc1ccc(cc1)n1cncc1C(=O)O
Properties
Complexity:
242
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
265.969g/mol
Formal Charge:
0
Heavy Atom Count:
15
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
267.082g/mol
Monoisotopic Mass:
265.969g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
55.1A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.2
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