CAS
94277-25-5 Purity
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94277-25-5 Purity
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2-Dodecylhexadecyl octanoate
CAS
94277-30-2
Catalog Number
ACM94277302
Category
Other Products
Molecular Weight
536.955680 [g/mol]
Molecular Formula
C36H72O2
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Specification
Synonyms
2-Dodecylhexadecyl octanoate, EINECS 304-613-7, CID3024203, 94277-30-2
IUPAC Name
2-dodecylhexadecyl octanoate
SMILES
CCCCCCCCCCCCCCC(CCCCCCCCCCCC)COC(=O)CCCCCCC
InChI Key
PYPZOHGTMJFJCP-UHFFFAOYSA-N
Boiling Point
543.4ºC at 760 mmHg
Flash Point
289ºC
Density
0.856g/cm³
EC Number
304-613-7
Exact Mass
536.55300
H-Bond Acceptor
2
H-Bond Donor
0
What is the molecular formula of 2-Dodecylhexadecyl octanoate?
The molecular formula of 2-Dodecylhexadecyl octanoate is C36H72O2.
What is the molecular weight of 2-Dodecylhexadecyl octanoate?
The molecular weight of 2-Dodecylhexadecyl octanoate is 537.0 g/mol.
What is the IUPAC name of 2-Dodecylhexadecyl octanoate?
The IUPAC name of 2-Dodecylhexadecyl octanoate is 2-dodecylhexadecyl octanoate.
What is the InChIKey of 2-Dodecylhexadecyl octanoate?
The InChIKey of 2-Dodecylhexadecyl octanoate is PYPZOHGTMJFJCP-UHFFFAOYSA-N.
What is the canonical SMILES of 2-Dodecylhexadecyl octanoate?
The canonical SMILES of 2-Dodecylhexadecyl octanoate is CCCCCCCCCCCCCCC(CCCCCCCCCCCC)COC(=O)CCCCCCC.
What is the CAS number of 2-Dodecylhexadecyl octanoate?
The CAS number of 2-Dodecylhexadecyl octanoate is 94277-30-2.
What is the XLogP3-AA value of 2-Dodecylhexadecyl octanoate?
The XLogP3-AA value of 2-Dodecylhexadecyl octanoate is 17.1.
How many hydrogen bond donor counts does 2-Dodecylhexadecyl octanoate have?
2-Dodecylhexadecyl octanoate has 0 hydrogen bond donor count.
What is the topological polar surface area of 2-Dodecylhexadecyl octanoate?
The topological polar surface area of 2-Dodecylhexadecyl octanoate is 26.3Ų.
Is the compound canonicalized?
Yes, the compound is canonicalized.
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