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100226-58-2 | 2-Propenoic acid, 2-[2-(4-nonylphenoxy)ethoxy]ethyl ester
CAS No: 100226-58-2 Catalog No: AG0001B0 MDL No:
Product Description
Catalog Number:
AG0001B0
Chemical Name:
2-Propenoic acid, 2-[2-(4-nonylphenoxy)ethoxy]ethyl ester
CAS Number:
100226-58-2
Molecular Formula:
C22H34O4
Molecular Weight:
362.5030
IUPAC Name:
2-[2-(4-nonylphenoxy)ethoxy]ethyl prop-2-enoate
InChI:
InChI=1S/C22H34O4/c1-3-5-6-7-8-9-10-11-20-12-14-21(15-13-20)25-18-16-24-17-19-26-22(23)4-2/h4,12-15H,2-3,5-11,16-19H2,1H3
InChI Key:
PAIUXEIIHOIUCD-UHFFFAOYSA-N
SMILES:
CCCCCCCCCc1ccc(cc1)OCCOCCOC(=O)C=C
Properties
Complexity:
348
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
362.246g/mol
Formal Charge:
0
Heavy Atom Count:
26
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
362.51g/mol
Monoisotopic Mass:
362.246g/mol
Rotatable Bond Count:
17
Topological Polar Surface Area:
44.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
6.8
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