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195436-88-5 | 2-(4-Iodophenyl)oxazole
CAS No: 195436-88-5 Catalog No: AG00748Y MDL No:MFCD04973402
Product Description
Catalog Number:
AG00748Y
Chemical Name:
2-(4-Iodophenyl)oxazole
CAS Number:
195436-88-5
Molecular Formula:
C9H6INO
Molecular Weight:
271.0545
MDL Number:
MFCD04973402
IUPAC Name:
2-(4-iodophenyl)-1,3-oxazole
InChI:
InChI=1S/C9H6INO/c10-8-3-1-7(2-4-8)9-11-5-6-12-9/h1-6H
InChI Key:
BJNRAXNXFISPNV-UHFFFAOYSA-N
SMILES:
Ic1ccc(cc1)c1ncco1
Properties
Complexity:
146
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
270.949g/mol
Formal Charge:
0
Heavy Atom Count:
12
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
271.057g/mol
Monoisotopic Mass:
270.949g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
26A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.6
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