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163675-88-5 | Tetradecanoic acid, 2-(dimethylamino)-1-methylethyl ester
CAS No: 163675-88-5 Catalog No: AG001UB7 MDL No:
Product Description
Catalog Number:
AG001UB7
Chemical Name:
Tetradecanoic acid, 2-(dimethylamino)-1-methylethyl ester
CAS Number:
163675-88-5
Molecular Formula:
C19H39NO2
Molecular Weight:
313.5185
IUPAC Name:
1-(dimethylamino)propan-2-yl tetradecanoate
InChI:
InChI=1S/C19H39NO2/c1-5-6-7-8-9-10-11-12-13-14-15-16-19(21)22-18(2)17-20(3)4/h18H,5-17H2,1-4H3
InChI Key:
KIPQYJOLEGBNHQ-UHFFFAOYSA-N
SMILES:
CCCCCCCCCCCCCC(=O)OC(CN(C)C)C
Properties
Complexity:
254
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
313.298g/mol
Formal Charge:
0
Heavy Atom Count:
22
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
313.526g/mol
Monoisotopic Mass:
313.298g/mol
Rotatable Bond Count:
16
Topological Polar Surface Area:
29.5A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
0
XLogP3:
6.8
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