Sucrose pentamyristate

CAS

94139-16-9

Catalog Number

ACM94139169

Category

Other Products

Molecular Weight

1394.07468

Molecular Formula

C₈₂H₁₅₂O₁₆

MSDS COA Spec Sheet

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Specification

Synonyms

Sucrose pentamyristate, EINECS 303-032-6, 94139-16-9

IUPAC Name

[(2R,3R,4S,5S)-5-[(2R,3R,4S,5S,6R)-4,5-dihydroxy-6-(hydroxymethyl)-3-tetradecanoyloxyoxan-2-yl]oxy-3,4-di(tetradecanoyloxy)-5-(tetradecanoyloxymethyl)oxolan-2-yl]methyl tetradecanoate

Canonical SMILES

CCCCCCCCCCCCCC(=O)OCC1C(C(C(O1)(COC(=O)CCCCCCCCCCCCC)OC2C(C(C(C(O2)CO)O)O)OC(=O)CCCCCCCCCCCCC)OC(=O)CCCCCCCCCCCCC)OC(=O)CCCCCCCCCCCCC

InChI Key

BZYKMLANACVTGP-SPSJIOHRSA-N

Density

1.04g/cm³

EC Number

303-032-6

Exact Mass

1393.11000

H-Bond Acceptor

H-Bond Donor

What is the molecular formula of Sucrose pentamyristate?

The molecular formula of Sucrose pentamyristate is C82H152O16.

When was Sucrose pentamyristate created and last modified?

Sucrose pentamyristate was created on August 20, 2009, and last modified on December 30, 2023.

What is the IUPAC Name of Sucrose pentamyristate?

The IUPAC Name of Sucrose pentamyristate is [(2R,3R,4S,5S)-5-[(2R,3R,4S,5S,6R)-4,5-dihydroxy-6-(hydroxymethyl)-3-tetradecanoyloxyoxan-2-yl]oxy-3,4-di(tetradecanoyloxy)-5-(tetradecanoyloxymethyl)oxolan-2-yl]methyl tetradecanoate.

What is the InChIKey of Sucrose pentamyristate?

The InChIKey of Sucrose pentamyristate is BZYKMLANACVTGP-SPSJIOHRSA-N.

How many hydrogen bond acceptors does Sucrose pentamyristate have?

Sucrose pentamyristate has 16 hydrogen bond acceptors.

What is the XLogP3-AA value of Sucrose pentamyristate?

The XLogP3-AA value of Sucrose pentamyristate is 29.1.

What is the exact mass of Sucrose pentamyristate?

The exact mass of Sucrose pentamyristate is 1393.10803876 g/mol.

How many rotatable bond counts does Sucrose pentamyristate have?

Sucrose pentamyristate has 75 rotatable bond counts.

What is the topological polar surface area of Sucrose pentamyristate?

The topological polar surface area of Sucrose pentamyristate is 220 Angstrom^2.