CAS
939807-60-0 Purity
96%
939807-60-0 Purity
96%
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2,3-Bis-(2-hydroxy-1-oxopropoxy)propyl palmitate
CAS
93980-78-0
Catalog Number
ACM93980780
Category
Other Products
Molecular Weight
474.627940 [g/mol]
Molecular Formula
C25H46O8
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Specification
Synonyms
EINECS 301-058-2, CID3023141, 2,3-Bis(2-hydroxy-1-oxopropoxy)propyl palmitate, 93980-78-0
IUPAC Name
2,3-bis(2-hydroxypropanoyloxy)propyl hexadecanoate
Canonical SMILES
CCCCCCCCCCCCCCCC(=O)OCC(COC(=O)C(C)O)OC(=O)C(C)O
InChI Key
VBXKJDLCCOSZKQ-UHFFFAOYSA-N
Boiling Point
531.6ºC at 760mmHg
Flash Point
160.9ºC
Density
1.059g/cm³
EC Number
301-058-2
Exact Mass
474.31900
H-Bond Acceptor
8
H-Bond Donor
2
What is the molecular formula of 2,3-Bis-(2-hydroxy-1-oxopropoxy)propyl palmitate?
The molecular formula is C25H46O8.
What is the molecular weight of 2,3-Bis-(2-hydroxy-1-oxopropoxy)propyl palmitate?
The molecular weight is 474.6 g/mol.
What is the IUPAC name of 2,3-Bis-(2-hydroxy-1-oxopropoxy)propyl palmitate?
The IUPAC name is 2,3-bis(2-hydroxypropanoyloxy)propyl hexadecanoate.
What is the InChIKey for 2,3-Bis-(2-hydroxy-1-oxopropoxy)propyl palmitate?
The InChIKey is VBXKJDLCCOSZKQ-UHFFFAOYSA-N.
What is the Canonical SMILES for 2,3-Bis-(2-hydroxy-1-oxopropoxy)propyl palmitate?
The Canonical SMILES is CCCCCCCCCCCCCCCC(=O)OCC(COC(=O)C(C)O)OC(=O)C(C)O.
What is the CAS number of 2,3-Bis-(2-hydroxy-1-oxopropoxy)propyl palmitate?
The CAS number is 93980-78-0.
What is the XLogP3-AA value for 2,3-Bis-(2-hydroxy-1-oxopropoxy)propyl palmitate?
The XLogP3-AA value is 6.8.
How many hydrogen bond donor counts does 2,3-Bis-(2-hydroxy-1-oxopropoxy)propyl palmitate have?
It has 2 hydrogen bond donor counts.
How many rotatable bond counts does 2,3-Bis-(2-hydroxy-1-oxopropoxy)propyl palmitate have?
It has 24 rotatable bond counts.
Is 2,3-Bis-(2-hydroxy-1-oxopropoxy)propyl palmitate a canonicalized compound?
Yes, it is a canonicalized compound.
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