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Home > Aldehydes > 106848-46-8
106848-46-8 | 1H-Imidazole-2-carboxaldehyde, 4,5-dibromo-
CAS No: 106848-46-8 Catalog No: AG007TV0 MDL No:
Product Description
Catalog Number:
AG007TV0
Chemical Name:
1H-Imidazole-2-carboxaldehyde, 4,5-dibromo-
CAS Number:
106848-46-8
Molecular Formula:
C4H2Br2N2O
Molecular Weight:
253.8795
IUPAC Name:
4,5-dibromo-1H-imidazole-2-carbaldehyde
InChI:
InChI=1S/C4H2Br2N2O/c5-3-4(6)8-2(1-9)7-3/h1H,(H,7,8)
InChI Key:
PTXUTZHXTGRTQK-UHFFFAOYSA-N
SMILES:
O=Cc1[nH]c(c(n1)Br)Br
Properties
Complexity:
121
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
253.851g/mol
Formal Charge:
0
Heavy Atom Count:
9
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
253.881g/mol
Monoisotopic Mass:
251.853g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
45.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0.7
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