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Structure

Sorbitan,tetradodecanoate

CAS
93963-93-0
Catalog Number
ACM93963930
Category
Other Products
Molecular Weight
893.366400 [g/mol]
Molecular Formula
C54H100O9

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Specification

Synonyms
Sorbitan, tetradodecanoate, EINECS 300-839-5, 93963-93-0
IUPAC Name
[(2R)-2-[(2R,3R,4S)-3,4-di(dodecanoyloxy)oxolan-2-yl]-2-dodecanoyloxyethyl] dodecanoate
Canonical SMILES
CCCCCCCCCCCC(=O)OCC(C1C(C(CO1)OC(=O)CCCCCCCCCCC)OC(=O)CCCCCCCCCCC)OC(=O)CCCCCCCCCCC
InChI Key
YWSDIOKOZYVZFR-OHTOXZDKSA-N
EC Number
300-839-5
Exact Mass
892.73700
H-Bond Acceptor
9
H-Bond Donor
0
What is the molecular formula of Sorbitan, tetradodecanoate?

The molecular formula of Sorbitan, tetradodecanoate is C54H100O9.

When was Sorbitan, tetradodecanoate first created in PubChem?

Sorbitan, tetradodecanoate was first created in PubChem on August 20, 2009.

What is the molecular weight of Sorbitan, tetradodecanoate?

The molecular weight of Sorbitan, tetradodecanoate is 893.4 g/mol.

What is the IUPAC name of Sorbitan, tetradodecanoate?

The IUPAC name of Sorbitan, tetradodecanoate is [(2R)-2-[(2R,3R,4S)-3,4-di(dodecanoyloxy)oxolan-2-yl]-2-dodecanoyloxyethyl] dodecanoate.

What is the InChIKey of Sorbitan, tetradodecanoate?

The InChIKey of Sorbitan, tetradodecanoate is YWSDIOKOZYVZFR-OHTOXZDKSA-N.

What is the Canonical SMILES of Sorbitan, tetradodecanoate?

The Canonical SMILES of Sorbitan, tetradodecanoate is CCCCCCCCCCCC(=O)OCC(C1C(C(CO1)OC(=O)CCCCCCCCCCC)OC(=O)CCCCCCCCCCC)OC(=O)CCCCCCCCCCC.

What is the CAS number of Sorbitan, tetradodecanoate?

The CAS number of Sorbitan, tetradodecanoate is 93963-93-0.

What is the XLogP3-AA value of Sorbitan, tetradodecanoate?

The XLogP3-AA value of Sorbitan, tetradodecanoate is 20.3.

How many hydrogen bond acceptor counts are there in Sorbitan, tetradodecanoate?

There are 9 hydrogen bond acceptor counts in Sorbitan, tetradodecanoate.

What is the topological polar surface area of Sorbitan, tetradodecanoate?

The topological polar surface area of Sorbitan, tetradodecanoate is 114Å^2.

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