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1240617-68-8 | Oxazole, 4-chloro-5-phenyl-
CAS No: 1240617-68-8 Catalog No: AG000LHZ MDL No:
Product Description
Catalog Number:
AG000LHZ
Chemical Name:
Oxazole, 4-chloro-5-phenyl-
CAS Number:
1240617-68-8
Molecular Formula:
C9H6ClNO
Molecular Weight:
179.6030
IUPAC Name:
4-chloro-5-phenyl-1,3-oxazole
InChI:
InChI=1S/C9H6ClNO/c10-9-8(12-6-11-9)7-4-2-1-3-5-7/h1-6H
InChI Key:
ODBCEDGHOYWPGF-UHFFFAOYSA-N
SMILES:
Clc1ncoc1c1ccccc1
Properties
Complexity:
148
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:
3
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