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115102-78-8 | 1,2-Dioxolane-3-acetic acid, 3,5-dimethyl-5-pentadecyl-
CAS No: 115102-78-8 Catalog No: AG000GB0 MDL No:
Product Description
Catalog Number:
AG000GB0
Chemical Name:
1,2-Dioxolane-3-acetic acid, 3,5-dimethyl-5-pentadecyl-
CAS Number:
115102-78-8
Molecular Formula:
C22H42O4
Molecular Weight:
370.5665
IUPAC Name:
2-(3,5-dimethyl-5-pentadecyldioxolan-3-yl)acetic acid
InChI:
InChI=1S/C22H42O4/c1-4-5-6-7-8-9-10-11-12-13-14-15-16-17-21(2)19-22(3,26-25-21)18-20(23)24/h4-19H2,1-3H3,(H,23,24)
InChI Key:
CELFHYKIFSVOLG-UHFFFAOYSA-N
SMILES:
CCCCCCCCCCCCCCCC1(C)OOC(C1)(C)CC(=O)O
Properties
Complexity:
384
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
370.308g/mol
Formal Charge:
0
Heavy Atom Count:
26
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
370.574g/mol
Monoisotopic Mass:
370.308g/mol
Rotatable Bond Count:
16
Topological Polar Surface Area:
55.8A^2
Undefined Atom Stereocenter Count:
2
Undefined Bond Stereocenter Count:
0
XLogP3:
8
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