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898760-11-7 | 2-(4-PENTYLBENZOYL)OXAZOLE
CAS No: 898760-11-7 Catalog No: AG00GW8F MDL No:
Product Description
Catalog Number:
AG00GW8F
Chemical Name:
2-(4-PENTYLBENZOYL)OXAZOLE
CAS Number:
898760-11-7
IUPAC Name:
1,3-oxazol-2-yl-(4-pentylphenyl)methanone
InChI:
InChI=1S/C15H17NO2/c1-2-3-4-5-12-6-8-13(9-7-12)14(17)15-16-10-11-18-15/h6-11H,2-5H2,1H3
InChI Key:
GXJUUBJDTMZAPI-UHFFFAOYSA-N
Properties
Complexity:
259
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
243.126g/mol
Formal Charge:
0
Heavy Atom Count:
18
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
243.306g/mol
Monoisotopic Mass:
243.126g/mol
Rotatable Bond Count:
6
Topological Polar Surface Area:
43.1A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
4.4
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