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192881-82-6 | Propanedioic acid, 2-(1-methyltetradecyl)-, 1,3-diethyl ester
CAS No: 192881-82-6 Catalog No: AG002GG1 MDL No:
Product Description
Catalog Number:
AG002GG1
Chemical Name:
Propanedioic acid, 2-(1-methyltetradecyl)-, 1,3-diethyl ester
CAS Number:
192881-82-6
Molecular Formula:
C22H42O4
Molecular Weight:
370.5665
IUPAC Name:
diethyl 2-pentadecan-2-ylpropanedioate
InChI:
InChI=1S/C22H42O4/c1-5-8-9-10-11-12-13-14-15-16-17-18-19(4)20(21(23)25-6-2)22(24)26-7-3/h19-20H,5-18H2,1-4H3
InChI Key:
UVKPINZNHZFZAR-UHFFFAOYSA-N
SMILES:
CCCCCCCCCCCCCC(C(C(=O)OCC)C(=O)OCC)C
Properties
Complexity:
336
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:
0
Isotope Atom Count:
0
Molecular Weight:
370.574g/mol
Monoisotopic Mass:
370.308g/mol
Rotatable Bond Count:
19
Topological Polar Surface Area:
52.6A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
0
XLogP3:
8.7
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