CAS
93777-16-3 Purity
96%
93777-16-3 Purity
96%
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Dodecyl[4-(1,3-dioxobutyl)phenoxy]acetate
CAS
93777-21-0
Catalog Number
ACM93777210
Category
Other Products
Molecular Weight
404.539640 [g/mol]
Molecular Formula
C24H36O5
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Specification
Synonyms
EINECS 298-050-3, CID3022295, Dodecyl (4-(1,3-dioxobutyl)phenoxy)acetate, 93777-21-0
IUPAC Name
dodecyl 2-[4-(3-oxobutanoyl)phenoxy]acetate
Canonical SMILES
CCCCCCCCCCCCOC(=O)COC1=CC=C(C=C1)C(=O)CC(=O)C
InChI Key
AKATWDMRLRLIRX-UHFFFAOYSA-N
Boiling Point
524.2ºC at 760 mmHg
Flash Point
223.2ºC
Density
1.028g/cm³
EC Number
298-050-3
Exact Mass
404.25600
H-Bond Acceptor
5
H-Bond Donor
0
What is the molecular formula of Dodecyl[4-(1,3-dioxobutyl)phenoxy]acetate?
The molecular formula is C24H36O5.
What is the molecular weight of Dodecyl[4-(1,3-dioxobutyl)phenoxy]acetate?
The molecular weight is 404.5 g/mol.
What is the IUPAC name of Dodecyl[4-(1,3-dioxobutyl)phenoxy]acetate?
dodecyl 2-[4-(3-oxobutanoyl)phenoxy]acetate.
What is the InChIKey of Dodecyl[4-(1,3-dioxobutyl)phenoxy]acetate?
AKATWDMRLRLIRX-UHFFFAOYSA-N.
How many hydrogen bond donor counts does Dodecyl[4-(1,3-dioxobutyl)phenoxy]acetate have?
0 hydrogen bond donor counts.
How many hydrogen bond acceptor counts does Dodecyl[4-(1,3-dioxobutyl)phenoxy]acetate have?
5 hydrogen bond acceptor counts.
What is the topological polar surface area of Dodecyl[4-(1,3-dioxobutyl)phenoxy]acetate?
69.7 Ų.
How many rotatable bond counts does Dodecyl[4-(1,3-dioxobutyl)phenoxy]acetate have?
18 rotatable bond counts.
Is Dodecyl[4-(1,3-dioxobutyl)phenoxy]acetate a canonicalized compound?
Yes, it is canonicalized.
What is the CAS number of Dodecyl[4-(1,3-dioxobutyl)phenoxy]acetate?
The CAS number is 93777-21-0.
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CAS
93777-30-1 Purity
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93777-30-1 Purity
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