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141888-10-0 | Hexanedioic acid, 1,6-bis(3-phenyl-2-propen-1-yl) ester
CAS No: 141888-10-0 Catalog No: AG001HBQ MDL No:
Product Description
Catalog Number:
AG001HBQ
Chemical Name:
Hexanedioic acid, 1,6-bis(3-phenyl-2-propen-1-yl) ester
CAS Number:
141888-10-0
Molecular Formula:
C24H26O4
Molecular Weight:
378.4608
IUPAC Name:
bis(3-phenylprop-2-enyl) hexanedioate
InChI:
InChI=1S/C24H26O4/c25-23(27-19-9-15-21-11-3-1-4-12-21)17-7-8-18-24(26)28-20-10-16-22-13-5-2-6-14-22/h1-6,9-16H,7-8,17-20H2
InChI Key:
WHVISQKLGCUNJR-UHFFFAOYSA-N
SMILES:
O=C(OCC=Cc1ccccc1)CCCCC(=O)OCC=Cc1ccccc1
Properties
Complexity:
451
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
378.183g/mol
Formal Charge:
0
Heavy Atom Count:
28
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
378.468g/mol
Monoisotopic Mass:
378.183g/mol
Rotatable Bond Count:
13
Topological Polar Surface Area:
52.6A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
2
XLogP3:
4.9
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