CAS 110-36-1 | MYRISTIC ACID N-BUTYL ESTER | CAS Number 110-36-1

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110-36-1 | MYRISTIC ACID N-BUTYL ESTER

CAS No: 110-36-1 Catalog No: AG003S6V MDL No:MFCD00015077

Product Description

Catalog Number:

AG003S6V

Chemical Name:

MYRISTIC ACID N-BUTYL ESTER

CAS Number:

110-36-1

Molecular Formula:

C18H36O2

Molecular Weight:

284.4772

MDL Number:

MFCD00015077

IUPAC Name:

butyl tetradecanoate

InChI:

InChI=1S/C18H36O2/c1-3-5-7-8-9-10-11-12-13-14-15-16-18(19)20-17-6-4-2/h3-17H2,1-2H3

InChI Key:

DHAZIUXMHRHVMP-UHFFFAOYSA-N

SMILES:

CCCCCCCCCCCCCC(=O)OCCCC

EC Number:

203-759-8

UNII:

O061W4C37H

NSC Number:

4814

Properties

Complexity:

202

Compound Is Canonicalized:

Yes

Covalently-Bonded Unit Count:

Defined Atom Stereocenter Count:

Defined Bond Stereocenter Count:

Exact Mass:

284.272g/mol

Formal Charge:

Heavy Atom Count:

Hydrogen Bond Acceptor Count:

Hydrogen Bond Donor Count:

Isotope Atom Count:

Molecular Weight:

284.484g/mol

Monoisotopic Mass:

284.272g/mol

Rotatable Bond Count:

Topological Polar Surface Area:

26.3A^2

Undefined Atom Stereocenter Count:

Undefined Bond Stereocenter Count:

XLogP3:

7.6

Literature

Title	Journal
Chemical composition and antifungal activity of volatiles from three Opuntia species growing in Tunisia.	Pakistan journal of biological sciences : PJBS 20070801
Design, synthesis, antibacterial, and QSAR studies of myristic acid derivatives.	Bioorganic & medicinal chemistry letters 20060601