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844884-91-9 | 3-Bromo-3'-iso-propoxybenzophenone
CAS No: 844884-91-9 Catalog No: AG01EXPD MDL No:
Product Description
Catalog Number:
AG01EXPD
Chemical Name:
3-Bromo-3'-iso-propoxybenzophenone
CAS Number:
844884-91-9
Molecular Formula:
C16H15BrO2
Molecular Weight:
319.1931
IUPAC Name:
(3-bromophenyl)-(3-propan-2-yloxyphenyl)methanone
InChI:
InChI=1S/C16H15BrO2/c1-11(2)19-15-8-4-6-13(10-15)16(18)12-5-3-7-14(17)9-12/h3-11H,1-2H3
InChI Key:
WOMCOPOKOFYWPZ-UHFFFAOYSA-N
SMILES:
CC(Oc1cccc(c1)C(=O)c1cccc(c1)Br)C
Properties
Complexity:
303
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
318.026g/mol
Formal Charge:
0
Heavy Atom Count:
19
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
319.198g/mol
Monoisotopic Mass:
318.026g/mol
Rotatable Bond Count:
4
Topological Polar Surface Area:
26.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
4.7
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