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117397-31-6 | 1,4-Benzenedicarboxylic acid, 1,4-bis[4-(ethenyloxy)butyl] ester
CAS No: 117397-31-6 Catalog No: AG000E7M MDL No:
Product Description
Catalog Number:
AG000E7M
Chemical Name:
1,4-Benzenedicarboxylic acid, 1,4-bis[4-(ethenyloxy)butyl] ester
CAS Number:
117397-31-6
Molecular Formula:
C20H26O6
Molecular Weight:
362.4168
IUPAC Name:
bis(4-ethenoxybutyl) benzene-1,4-dicarboxylate
InChI:
InChI=1S/C20H26O6/c1-3-23-13-5-7-15-25-19(21)17-9-11-18(12-10-17)20(22)26-16-8-6-14-24-4-2/h3-4,9-12H,1-2,5-8,13-16H2
InChI Key:
HMNFSPVCKZFHGZ-UHFFFAOYSA-N
SMILES:
C=COCCCCOC(=O)c1ccc(cc1)C(=O)OCCCCOC=C
Properties
Complexity:
386
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
362.173g/mol
Formal Charge:
0
Heavy Atom Count:
26
Hydrogen Bond Acceptor Count:
6
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
362.422g/mol
Monoisotopic Mass:
362.173g/mol
Rotatable Bond Count:
16
Topological Polar Surface Area:
71.1A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
5.7
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