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21034-30-0 | 2(3H)-Furanone, 4-bromodihydro-5,5-diphenyl-
CAS No: 21034-30-0 Catalog No: AG002KP8 MDL No:
Product Description
Catalog Number:
AG002KP8
Chemical Name:
2(3H)-Furanone, 4-bromodihydro-5,5-diphenyl-
CAS Number:
21034-30-0
Molecular Formula:
C16H13BrO2
Molecular Weight:
317.1772
IUPAC Name:
4-bromo-5,5-diphenyloxolan-2-one
InChI:
InChI=1S/C16H13BrO2/c17-14-11-15(18)19-16(14,12-7-3-1-4-8-12)13-9-5-2-6-10-13/h1-10,14H,11H2
InChI Key:
BPCLQXLEWDHXBA-UHFFFAOYSA-N
SMILES:
BrC1CC(=O)OC1(c1ccccc1)c1ccccc1
Properties
Complexity:
312
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
316.01g/mol
Formal Charge:
0
Heavy Atom Count:
19
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
317.182g/mol
Monoisotopic Mass:
316.01g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
26.3A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
0
XLogP3:
3.7
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