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62881-98-5 | 2-(2-Chlorophenyl)oxazole
CAS No: 62881-98-5 Catalog No: AG003ERI MDL No:MFCD03407330
Product Description
Catalog Number:
AG003ERI
Chemical Name:
2-(2-Chlorophenyl)oxazole
CAS Number:
62881-98-5
Molecular Formula:
C9H6ClNO
Molecular Weight:
179.6030
MDL Number:
MFCD03407330
IUPAC Name:
2-(2-chlorophenyl)-1,3-oxazole
InChI:
InChI=1S/C9H6ClNO/c10-8-4-2-1-3-7(8)9-11-5-6-12-9/h1-6H
InChI Key:
IWUACMRENZNWBB-UHFFFAOYSA-N
SMILES:
Clc1ccccc1c1ncco1
Properties
Complexity:
154
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
179.014g/mol
Formal Charge:
0
Heavy Atom Count:
12
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
179.603g/mol
Monoisotopic Mass:
179.014g/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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