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88430-52-8 | Oxirane, 2-phenyl-3-(2-phenylethenyl)-
CAS No: 88430-52-8 Catalog No: AG004HMY MDL No:
Product Description
Catalog Number:
AG004HMY
Chemical Name:
Oxirane, 2-phenyl-3-(2-phenylethenyl)-
CAS Number:
88430-52-8
Molecular Formula:
C16H14O
Molecular Weight:
222.2818
IUPAC Name:
2-phenyl-3-(2-phenylethenyl)oxirane
InChI:
InChI=1S/C16H14O/c1-3-7-13(8-4-1)11-12-15-16(17-15)14-9-5-2-6-10-14/h1-12,15-16H
InChI Key:
JDRQDADZTNXGST-UHFFFAOYSA-N
SMILES:
c1ccc(cc1)C=CC1OC1c1ccccc1
Properties
Complexity:
259
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
222.104g/mol
Formal Charge:
0
Heavy Atom Count:
17
Hydrogen Bond Acceptor Count:
1
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
222.287g/mol
Monoisotopic Mass:
222.104g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
12.5A^2
Undefined Atom Stereocenter Count:
2
Undefined Bond Stereocenter Count:
1
XLogP3:
3.6
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