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Structure

Icosyl hexadecenoate

CAS
93882-43-0
Catalog Number
ACM93882430
Category
Other Products
Molecular Weight
534.939800 [g/mol]
Molecular Formula
C36H70O2

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Specification

Synonyms
Icosyl hexadecenoate, Hexadecenoic acid, eicosyl ester, EINECS 299-438-5, 93882-43-0
IUPAC Name
icosyl (E)-hexadec-2-enoate
Canonical SMILES
CCCCCCCCCCCCCCCCCCCCOC(=O)C=CCCCCCCCCCCCCC
InChI Key
QYYKZDPETREORG-NWBJSICCSA-N
Boiling Point
590.3ºC at 760 mmHg
Flash Point
312.8ºC
Density
0.862g/cm³
EC Number
299-438-5
Exact Mass
534.53800
H-Bond Acceptor
2
H-Bond Donor
0
What is the molecular formula of icosyl hexadecenoate?

The molecular formula of icosyl hexadecenoate is C36H70O2.

What is the molecular weight of icosyl hexadecenoate?

The molecular weight of icosyl hexadecenoate is 534.9 g/mol.

What is the IUPAC name of icosyl hexadecenoate?

The IUPAC name of icosyl hexadecenoate is icosyl (E)-hexadec-2-enoate.

What is the InChI of icosyl hexadecenoate?

The InChI of icosyl hexadecenoate is InChI=1S/C36H70O2/c1-3-5-7-9-11-13-15-17-18-19-20-21-23-25-27-29-31-33-35-38-36(37)34-32-30-28-26-24-22-16-14-12-10-8-6-4-2/h32,34H,3-31,33,35H2,1-2H3/b34-32+.

What is the InChIKey of icosyl hexadecenoate?

The InChIKey of icosyl hexadecenoate is QYYKZDPETREORG-NWBJSICCSA-N.

What is the canonical SMILES of icosyl hexadecenoate?

The canonical SMILES of icosyl hexadecenoate is CCCCCCCCCCCCCCCCCCCCOC(=O)C=CCCCCCCCCCCCCC.

What is the isomeric SMILES of icosyl hexadecenoate?

The isomeric SMILES of icosyl hexadecenoate is CCCCCCCCCCCCCCCCCCCCOC(=O)/C=C/CCCCCCCCCCCCC.

What is the CAS number of icosyl hexadecenoate?

The CAS number of icosyl hexadecenoate is 93882-43-0.

What is the EC number of icosyl hexadecenoate?

The EC number of icosyl hexadecenoate is 299-438-5.

Is icosyl hexadecenoate a canonicalized compound?

Yes, icosyl hexadecenoate is a canonicalized compound according to PubChem.

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