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116518-82-2

116518-82-2 | Tetradecanoic acid, 2,2-dimethylpropyl ester

CAS No: 116518-82-2 Catalog No: AG000CNQ MDL No:

Product Description

Catalog Number:
AG000CNQ
Chemical Name:
Tetradecanoic acid, 2,2-dimethylpropyl ester
CAS Number:
116518-82-2
Molecular Formula:
C19H38O2
Molecular Weight:
298.5038
IUPAC Name:
2,2-dimethylpropyl tetradecanoate
InChI:
InChI=1S/C19H38O2/c1-5-6-7-8-9-10-11-12-13-14-15-16-18(20)21-17-19(2,3)4/h5-17H2,1-4H3
InChI Key:
VUDOAEVYGXSOME-UHFFFAOYSA-N
SMILES:
CCCCCCCCCCCCCC(=O)OCC(C)(C)C

Properties

Complexity:
240  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
298.287g/mol
Formal Charge:
0
Heavy Atom Count:
21  
Hydrogen Bond Acceptor Count:
2  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
298.511g/mol
Monoisotopic Mass:
298.287g/mol
Rotatable Bond Count:
15  
Topological Polar Surface Area:
26.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
8.1  

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