CAS
98167-06-7 Purity
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98167-06-7 Purity
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Heptyl 12-hydroxyoleate
CAS
98167-55-6
Catalog Number
ACM98167556
Category
Other Products
Molecular Weight
396.646820 [g/mol]
Molecular Formula
C25H48O3
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Specification
Synonyms
Heptyl 12-hydroxyoleate, EINECS 308-640-5, CID6437779, 98167-55-6
IUPAC Name
heptyl (Z)-12-hydroxyoctadec-9-enoate
Canonical SMILES
CCCCCCCOC(=O)CCCCCCCC=CCC(CCCCCC)O
InChI Key
JYZMEVOAJGJTKL-LGMDPLHJSA-N
Boiling Point
491.7ºC at 760 mmHg
Flash Point
179.2ºC
Density
0.909g/cm³
EC Number
308-640-5
Exact Mass
396.36000
H-Bond Acceptor
3
H-Bond Donor
1
What is the molecular formula of Heptyl 12-hydroxyoleate?
The molecular formula is C25H48O3.
When was Heptyl 12-hydroxyoleate created on PubChem?
Heptyl 12-hydroxyoleate was created on 2006-04-28.
What is the computed IUPAC Name of Heptyl 12-hydroxyoleate?
The computed IUPAC Name is heptyl (Z)-12-hydroxyoctadec-9-enoate.
What is the InChIKey of Heptyl 12-hydroxyoleate?
The InChIKey is JYZMEVOAJGJTKL-LGMDPLHJSA-N.
How many hydrogen bond donor counts are there in Heptyl 12-hydroxyoleate?
There is 1 hydrogen bond donor count.
What is the exact mass of Heptyl 12-hydroxyoleate?
The exact mass is 396.36034539 g/mol.
How many rotatable bond counts are there in Heptyl 12-hydroxyoleate?
There are 22 rotatable bond counts.
What is the topological polar surface area of Heptyl 12-hydroxyoleate?
The topological polar surface area is 46.5 Ų.
Is Heptyl 12-hydroxyoleate a covalently-bonded unit?
Yes, Heptyl 12-hydroxyoleate is a covalently-bonded unit.
What is the molecular weight of Heptyl 12-hydroxyoleate?
The molecular weight is 396.6 g/mol.
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