Nonadecyltrifluoroacetate

Compound Structure:

Synonyms:

Nonadecyl 2,2,2-trifluoroacetate; Nonadecyl trifluoroacetate; nonadecyltrifluoroacetate; 1-Nonadecanol, trifluoroacetate

Compound ID:

NMPC-1324

PubChem ID:

Molecular Formula:

C21H39F3O2

Canonical SMILES:

CCCCCCCCCCCCCCCCCCCOC(=O)C(F)(F)F

InChIKey:

WEKMLKHOURBVLB-UHFFFAOYSA-N

About the compound:

Properties:

Chemical and Physical Properties

Computed Properties

Property Name	Property Value
Molecular Weight	380.5 g/mol
XLogP3	10.5
Hydrogen Bond Donor Count	0
Hydrogen Bond Acceptor Count	5
Rotatable Bond Count	19
Exact Mass	380.29021497 g/mol
Monoisotopic Mass	380.29021497 g/mol
Topological Polar Surface Area	26.3Å²
Heavy Atom Count	26
Formal Charge	0
Complexity	317
Isotope Atom Count	0
Defined Atom Stereocenter Count	0
Undefined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Undefined Bond Stereocenter Count	0
Covalently-Bonded Unit Count	1
Compound Is Canonicalized	Yes

Source: PubChem

Source Species:

Urena lobata

Download SDF