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121864-64-0 | 1,3-Dioxolane-2,2-dipropanoic acid, 2,2-dipropyl ester
CAS No: 121864-64-0 Catalog No: AG00165U MDL No:
Product Description
Catalog Number:
AG00165U
Chemical Name:
1,3-Dioxolane-2,2-dipropanoic acid, 2,2-dipropyl ester
CAS Number:
121864-64-0
Molecular Formula:
C15H26O6
Molecular Weight:
302.3633
IUPAC Name:
propyl 3-[2-(3-oxo-3-propoxypropyl)-1,3-dioxolan-2-yl]propanoate
InChI:
InChI=1S/C15H26O6/c1-3-9-18-13(16)5-7-15(20-11-12-21-15)8-6-14(17)19-10-4-2/h3-12H2,1-2H3
InChI Key:
JUHZKCUYIAOTFW-UHFFFAOYSA-N
SMILES:
CCCOC(=O)CCC1(CCC(=O)OCCC)OCCO1
Properties
Complexity:
296
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
302.173g/mol
Formal Charge:
0
Heavy Atom Count:
21
Hydrogen Bond Acceptor Count:
6
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
302.367g/mol
Monoisotopic Mass:
302.173g/mol
Rotatable Bond Count:
12
Topological Polar Surface Area:
71.1A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.8
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