CAS
93840-60-9 Purity
96%
93840-60-9 Purity
96%
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2-Hydroxyhexacosyl 12-hydroxyoctadecanoate
CAS
93840-69-8
Catalog Number
ACM93840698
Category
Other Products
Molecular Weight
681.167120 [g/mol]
Molecular Formula
C44H88O4
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Specification
Synonyms
EINECS 298-934-9, 2-Hydroxyhexacosyl 12-hydroxyoctadecanoate, CID3022576, 93840-69-8
IUPAC Name
2-hydroxyhexacosyl 12-hydroxyoctadecanoate
Canonical SMILES
CCCCCCCCCCCCCCCCCCCCCCCCC(COC(=O)CCCCCCCCCCC(CCCCCC)O)O
InChI Key
VIALDFXTEOLLGO-UHFFFAOYSA-N
Boiling Point
728.5ºC at 760 mmHg
Flash Point
196.4ºC
Density
0.903g/cm³
EC Number
298-934-9
Exact Mass
680.66800
H-Bond Acceptor
4
H-Bond Donor
2
What is the molecular formula of 2-Hydroxyhexacosyl 12-hydroxyoctadecanoate?
The molecular formula is C44H88O4.
What is the molecular weight of 2-Hydroxyhexacosyl 12-hydroxyoctadecanoate?
The molecular weight is 681.2 g/mol.
When was 2-Hydroxyhexacosyl 12-hydroxyoctadecanoate created and last modified?
It was created on August 8, 2005, and last modified on December 30, 2023.
What is the IUPAC name of 2-Hydroxyhexacosyl 12-hydroxyoctadecanoate?
The IUPAC name is 2-hydroxyhexacosyl 12-hydroxyoctadecanoate.
What is the InChIKey of 2-Hydroxyhexacosyl 12-hydroxyoctadecanoate?
The InChIKey is VIALDFXTEOLLGO-UHFFFAOYSA-N.
How many hydrogen bond donor counts does 2-Hydroxyhexacosyl 12-hydroxyoctadecanoate have?
It has 2 hydrogen bond donor counts.
What is the XLogP3-AA value of 2-Hydroxyhexacosyl 12-hydroxyoctadecanoate?
The XLogP3-AA value is 18.6.
How many rotatable bond counts does 2-Hydroxyhexacosyl 12-hydroxyoctadecanoate have?
It has 42 rotatable bond counts.
What is the topological polar surface area of 2-Hydroxyhexacosyl 12-hydroxyoctadecanoate?
The topological polar surface area is 66.8 Å2.
Is 2-Hydroxyhexacosyl 12-hydroxyoctadecanoate a canonicalized compound?
Yes, it is a canonicalized compound.
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