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885267-15-2 | 3-(3-Bromophenyl)cyclobutanone
CAS No: 885267-15-2 Catalog No: AG0089Q9 MDL No:MFCD08706340
Product Description
Catalog Number:
AG0089Q9
Chemical Name:
3-(3-Bromophenyl)cyclobutanone
CAS Number:
885267-15-2
Molecular Formula:
C10H9BrO
Molecular Weight:
225.0819
MDL Number:
MFCD08706340
IUPAC Name:
3-(3-bromophenyl)cyclobutan-1-one
InChI:
InChI=1S/C10H9BrO/c11-9-3-1-2-7(4-9)8-5-10(12)6-8/h1-4,8H,5-6H2
InChI Key:
RLKCJCIUTBLVRJ-UHFFFAOYSA-N
SMILES:
O=C1CC(C1)c1cccc(c1)Br
Properties
Complexity:
182
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
223.984g/mol
Formal Charge:
0
Heavy Atom Count:
12
Hydrogen Bond Acceptor Count:
1
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
225.085g/mol
Monoisotopic Mass:
223.984g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
17.1A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.1
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