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890099-66-8 | 4-ACETOXY-4'-ISOPROPYLBENZOPHENONE
CAS No: 890099-66-8 Catalog No: AG0043L5 MDL No:
Product Description
Catalog Number:
AG0043L5
Chemical Name:
4-ACETOXY-4'-ISOPROPYLBENZOPHENONE
CAS Number:
890099-66-8
Molecular Formula:
C18H18O3
Molecular Weight:
282.3337
IUPAC Name:
[4-(4-propan-2-ylbenzoyl)phenyl] acetate
InChI:
InChI=1S/C18H18O3/c1-12(2)14-4-6-15(7-5-14)18(20)16-8-10-17(11-9-16)21-13(3)19/h4-12H,1-3H3
InChI Key:
UFLFZEFDPBHEJW-UHFFFAOYSA-N
SMILES:
CC(=O)Oc1ccc(cc1)C(=O)c1ccc(cc1)C(C)C
Properties
Complexity:
359
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
282.126g/mol
Formal Charge:
0
Heavy Atom Count:
21
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
282.339g/mol
Monoisotopic Mass:
282.126g/mol
Rotatable Bond Count:
5
Topological Polar Surface Area:
43.4A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
4.1
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