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13668-03-6 | Benzene, 1,1',1''-(3-ethoxy-1-cyclopropene-1,2,3-triyl)tris-
CAS No: 13668-03-6 Catalog No: AG00127J MDL No:
Product Description
Catalog Number:
AG00127J
Chemical Name:
Benzene, 1,1',1''-(3-ethoxy-1-cyclopropene-1,2,3-triyl)tris-
CAS Number:
13668-03-6
Molecular Formula:
C23H20O
Molecular Weight:
312.4043
IUPAC Name:
(1-ethoxy-2,3-diphenylcycloprop-2-en-1-yl)benzene
InChI:
InChI=1S/C23H20O/c1-2-24-23(20-16-10-5-11-17-20)21(18-12-6-3-7-13-18)22(23)19-14-8-4-9-15-19/h3-17H,2H2,1H3
InChI Key:
DUFGOPMCDLNQKR-UHFFFAOYSA-N
SMILES:
CCOC1(c2ccccc2)C(=C1c1ccccc1)c1ccccc1
NSC Number:
167284
Properties
Complexity:
417
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
312.151g/mol
Formal Charge:
0
Heavy Atom Count:
24
Hydrogen Bond Acceptor Count:
1
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
312.412g/mol
Monoisotopic Mass:
312.151g/mol
Rotatable Bond Count:
5
Topological Polar Surface Area:
9.2A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
4.7
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