CAS
97465-82-2 Purity
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97465-82-2 Purity
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3,6,9,12,15,18-Hexaoxaicosane-1,20-diyl dioleate
CAS
97467-64-6
Catalog Number
ACM97467646
Category
Other Products
Molecular Weight
855.275360 [g/mol]
Molecular Formula
C50H94O10
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Specification
Synonyms
3,6,9,12,15,18-Hexaoxaicosane-1,20-diyl dioleate, 97467-64-6, CTK3I8272, AG-H-97344
IUPAC Name
2-[2-[2-[2-[2-[2-(2-octadec-9-enoyloxyethoxy)ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethyl octadec-9-enoate
Canonical SMILES
CCCCCCCCC=CCCCCCCCC(=O)OCCOCCOCCOCCOCCOCCOCCOC(=O)CCCCCCCC=CCCCCCCCC
InChI Key
PCQFPTYKFOPQLP-UHFFFAOYSA-N
Boiling Point
795.1ºC at 760mmHg
Flash Point
299.5ºC
Density
0.965g/cm³
EC Number
306-913-3
Exact Mass
854.68500
H-Bond Acceptor
10
H-Bond Donor
0
What is the molecular formula of 3,6,9,12,15,18-Hexaoxaicosane-1,20-diyl dioleate?
The molecular formula is C50H94O10.
What is the molecular weight of 3,6,9,12,15,18-Hexaoxaicosane-1,20-diyl dioleate?
The molecular weight is 855.3 g/mol.
When was 3,6,9,12,15,18-Hexaoxaicosane-1,20-diyl dioleate created?
It was created on August 20, 2009.
What is the IUPAC name of 3,6,9,12,15,18-Hexaoxaicosane-1,20-diyl dioleate?
The IUPAC name is 2-[2-[2-[2-[2-[2-[2-[(Z)-octadec-9-enoyl]oxyethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethyl (Z)-octadec-9-enoate.
What is the InChIKey of 3,6,9,12,15,18-Hexaoxaicosane-1,20-diyl dioleate?
The InChIKey is PCQFPTYKFOPQLP-CLFAGFIQSA-N.
How many hydrogen bond acceptor counts does 3,6,9,12,15,18-Hexaoxaicosane-1,20-diyl dioleate have?
It has 10 hydrogen bond acceptor counts.
What is the exact mass of 3,6,9,12,15,18-Hexaoxaicosane-1,20-diyl dioleate?
The exact mass is 854.68469919 g/mol.
How many rotatable bond counts does 3,6,9,12,15,18-Hexaoxaicosane-1,20-diyl dioleate have?
It has 53 rotatable bond counts.
How many defined bond stereocenter counts does 3,6,9,12,15,18-Hexaoxaicosane-1,20-diyl dioleate have?
It has 2 defined bond stereocenter counts.
Is 3,6,9,12,15,18-Hexaoxaicosane-1,20-diyl dioleate a canonicalized compound?
Yes, it is a canonicalized compound.
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