CAS
94278-33-8 Purity
96%
94278-33-8 Purity
96%
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1,4-Diethyloctyl acetate
CAS
94278-38-3
Catalog Number
ACM94278383
Category
Other Products
Molecular Weight
228.370920 [g/mol]
Molecular Formula
C14H28O2
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Specification
Synonyms
1,4-Diethyloctyl acetate, EINECS 304-728-2, CID3024248, 94278-38-3
IUPAC Name
6-ethyldecan-3-yl acetate
Canonical SMILES
CCCCC(CC)CCC(CC)OC(=O)C
InChI Key
KZSOZUVVYMQOGE-UHFFFAOYSA-N
Boiling Point
256.3ºC at 760 mmHg
Flash Point
115.6ºC
Density
0.865g/cm³
EC Number
304-728-2
Exact Mass
228.20900
H-Bond Acceptor
2
H-Bond Donor
0
What is the molecular formula of 1,4-Diethyloctyl acetate?
The molecular formula is C14H28O2.
When was the structure of 1,4-Diethyloctyl acetate created and modified?
The structure was created on 2005-08-08 and modified on 2023-12-30.
What is the IUPAC Name of 1,4-Diethyloctyl acetate?
The IUPAC Name is 6-ethyldecan-3-yl acetate.
What is the InChIKey of 1,4-Diethyloctyl acetate?
The InChIKey is KZSOZUVVYMQOGE-UHFFFAOYSA-N.
How many hydrogen bond donor counts does 1,4-Diethyloctyl acetate have?
1,4-Diethyloctyl acetate has 0 hydrogen bond donor count.
What is the topological polar surface area of 1,4-Diethyloctyl acetate?
The topological polar surface area is 26.3 Ų.
How many rotatable bond counts does 1,4-Diethyloctyl acetate have?
1,4-Diethyloctyl acetate has 10 rotatable bond counts.
Is 1,4-Diethyloctyl acetate considered canonicalized compound?
Yes, it is considered a canonicalized compound.
What is the molecular weight of 1,4-Diethyloctyl acetate?
The molecular weight is 228.37 g/mol.
What is the CAS number of 1,4-Diethyloctyl acetate?
The CAS number is 94278-38-3.
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94278-41-8 Purity
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