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60367-52-4 | 5-Chloro-2-phenyl-1H-imidazole-4-carbaldehyde
CAS No: 60367-52-4 Catalog No: AG003702 MDL No:MFCD01935953
Product Description
Catalog Number:
AG003702
Chemical Name:
5-Chloro-2-phenyl-1H-imidazole-4-carbaldehyde
CAS Number:
60367-52-4
Molecular Formula:
C10H7ClN2O
Molecular Weight:
206.6284
MDL Number:
MFCD01935953
IUPAC Name:
5-chloro-2-phenyl-1H-imidazole-4-carbaldehyde
InChI:
InChI=1S/C10H7ClN2O/c11-9-8(6-14)12-10(13-9)7-4-2-1-3-5-7/h1-6H,(H,12,13)
InChI Key:
CCXUATWKEDQRMP-UHFFFAOYSA-N
SMILES:
O=Cc1nc([nH]c1Cl)c1ccccc1
Properties
Complexity:
206
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
206.025g/mol
Formal Charge:
0
Heavy Atom Count:
14
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
206.629g/mol
Monoisotopic Mass:
206.025g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
45.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.5
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