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Home > Fluorides > 951885-71-5
951885-71-5 | 4-tert-Butyl-3'-fluorobenzophenone
CAS No: 951885-71-5 Catalog No: AG01EZNQ MDL No:
Product Description
Catalog Number:
AG01EZNQ
Chemical Name:
4-tert-Butyl-3'-fluorobenzophenone
CAS Number:
951885-71-5
Molecular Formula:
C17H17FO
Molecular Weight:
256.3147
IUPAC Name:
(4-tert-butylphenyl)-(3-fluorophenyl)methanone
InChI:
InChI=1S/C17H17FO/c1-17(2,3)14-9-7-12(8-10-14)16(19)13-5-4-6-15(18)11-13/h4-11H,1-3H3
InChI Key:
QUCZCTICFVDNHS-UHFFFAOYSA-N
SMILES:
Fc1cccc(c1)C(=O)c1ccc(cc1)C(C)(C)C
Properties
Complexity:
310
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
256.126g/mol
Formal Charge:
0
Heavy Atom Count:
19
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
256.32g/mol
Monoisotopic Mass:
256.126g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
17.1A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
5.1
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