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847480-87-9 | 5-Oxo-5-(3-phenylpropoxy)pentanoic acid
CAS No: 847480-87-9 Catalog No: AG01FOAY MDL No:
Product Description
Catalog Number:
AG01FOAY
Chemical Name:
5-Oxo-5-(3-phenylpropoxy)pentanoic acid
CAS Number:
847480-87-9
IUPAC Name:
5-oxo-5-(3-phenylpropoxy)pentanoic acid
InChI:
InChI=1S/C14H18O4/c15-13(16)9-4-10-14(17)18-11-5-8-12-6-2-1-3-7-12/h1-3,6-7H,4-5,8-11H2,(H,15,16)
InChI Key:
FHZZJODNIQXLLC-UHFFFAOYSA-N
Properties
Complexity:
257
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
250.121g/mol
Formal Charge:
0
Heavy Atom Count:
18
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
250.294g/mol
Monoisotopic Mass:
250.121g/mol
Rotatable Bond Count:
9
Topological Polar Surface Area:
63.6A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.3
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