CAS
94108-40-4 Purity
96%
94108-40-4 Purity
96%
![N-[3-[(Aminocarbonyl)amino]phenyl]-3-hydroxy-4-[(4-methyl-2-nitrophenyl)azo]naphthalene-2-carboxamide](https://resource.alfa-chemistry.com/structure/94108-47-1.gif)
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Methyl(Z)-1-(octadec-9-enyl)-5-oxopyrrolidine-3-carboxylate
CAS
94108-43-7
Catalog Number
ACM94108437
Category
Other Products
Molecular Weight
393.603120 [g/mol]
Molecular Formula
C24H43NO3
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Specification
Synonyms
EINECS 302-383-2, Methyl (Z)-1-(octadec-9-enyl)-5-oxopyrrolidine-3-carboxylate, 94108-43-7
IUPAC Name
methyl 1-[(Z)-octadec-9-enyl]-5-oxopyrrolidine-3-carboxylate
Canonical SMILES
CCCCCCCCC=CCCCCCCCCN1CC(CC1=O)C(=O)OC
InChI Key
IGYHVXBJVMNSAV-KHPPLWFESA-N
Boiling Point
513.6ºC at 760mmHg
Flash Point
264.4ºC
Density
0.961g/cm³
EC Number
302-383-2
Exact Mass
393.32400
H-Bond Acceptor
3
H-Bond Donor
0
What is the molecular formula of the compound with PubChem CID 20833814?
The molecular formula is C24H43NO3.
When was the compound with PubChem CID 20833814 created and last modified?
It was created on 2007-12-05 and last modified on 2023-12-30.
What is the IUPAC name of the compound with PubChem CID 20833814?
The IUPAC name is methyl 1-[(Z)-octadec-9-enyl]-5-oxopyrrolidine-3-carboxylate.
What is the InChI key of the compound with PubChem CID 20833814?
The InChI key is IGYHVXBJVMNSAV-KHPPLWFESA-N.
How many rotatable bonds does the compound with PubChem CID 20833814 have?
It has 18 rotatable bonds.
What is the exact mass of the compound with PubChem CID 20833814?
The exact mass is 393.32429423 g/mol.
How many hydrogen bond acceptors does the compound with PubChem CID 20833814 have?
It has 3 hydrogen bond acceptors.
What is the XLogP3-AA value of the compound with PubChem CID 20833814?
The XLogP3-AA value is 7.2.
Does the compound with PubChem CID 20833814 have any defined atom stereocenters?
No, it does not have any defined atom stereocenters.
Is the compound with PubChem CID 20833814 canonicalized?
Yes, the compound is canonicalized.
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