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89676-04-0 | Cyclopentanone, 3-(diphenylmethyl)-
CAS No: 89676-04-0 Catalog No: AG0042YF MDL No:
Product Description
Catalog Number:
AG0042YF
Chemical Name:
Cyclopentanone, 3-(diphenylmethyl)-
CAS Number:
89676-04-0
Molecular Formula:
C18H18O
Molecular Weight:
250.3349
IUPAC Name:
3-benzhydrylcyclopentan-1-one
InChI:
InChI=1S/C18H18O/c19-17-12-11-16(13-17)18(14-7-3-1-4-8-14)15-9-5-2-6-10-15/h1-10,16,18H,11-13H2
InChI Key:
SIRQIMKTUZSVOQ-UHFFFAOYSA-N
SMILES:
O=C1CCC(C1)C(c1ccccc1)c1ccccc1
Properties
Complexity:
279
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
250.136g/mol
Formal Charge:
0
Heavy Atom Count:
19
Hydrogen Bond Acceptor Count:
1
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
250.341g/mol
Monoisotopic Mass:
250.136g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
17.1A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
0
XLogP3:
3.7
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