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13282-85-4 | 2-Propenoic acid, 3-(dodecyloxy)-2-hydroxypropyl ester
CAS No: 13282-85-4 Catalog No: AG00117Y MDL No:
Product Description
Catalog Number:
AG00117Y
Chemical Name:
2-Propenoic acid, 3-(dodecyloxy)-2-hydroxypropyl ester
CAS Number:
13282-85-4
Molecular Formula:
C18H34O4
Molecular Weight:
314.4602
IUPAC Name:
(3-dodecoxy-2-hydroxypropyl) prop-2-enoate
InChI:
InChI=1S/C18H34O4/c1-3-5-6-7-8-9-10-11-12-13-14-21-15-17(19)16-22-18(20)4-2/h4,17,19H,2-3,5-16H2,1H3
InChI Key:
GNWGMEIOPBRGJW-UHFFFAOYSA-N
SMILES:
CCCCCCCCCCCCOCC(COC(=O)C=C)O
EC Number:
603-673-4
Properties
Complexity:
266
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
314.246g/mol
Formal Charge:
0
Heavy Atom Count:
22
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
314.466g/mol
Monoisotopic Mass:
314.246g/mol
Rotatable Bond Count:
17
Topological Polar Surface Area:
55.8A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
0
XLogP3:
5.5
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