CAS
94108-47-1 Purity
96%
94108-47-1 Purity
96%
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[(2,2,8-Trimethyl-4H-1,3-dioxino[4,5-c]pyridin-5-yl)methyl]hydrogen succinate
CAS
94108-52-8
Catalog Number
ACM94108528
Category
Other Products
Molecular Weight
309.314460 [g/mol]
Molecular Formula
C15H19NO6
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Specification
Synonyms
EINECS 302-393-7, ((2,2,8-Trimethyl-4H-1,3-dioxino(4,5-c)pyridin-5-yl)methyl) hydrogen succinate, 94108-52-8
IUPAC Name
4-oxo-4-[(2,2,8-trimethyl-4H-[1,3]dioxino[4,5-c]pyridin-5-yl)methoxy]butanoic acid
InChI Key
QXAWEIDCMROCDU-UHFFFAOYSA-N
Boiling Point
471.3ºC at 760 mmHg
Flash Point
238.8ºC
Density
1.253g/cm³
Exact Mass
309.12100
H-Bond Acceptor
7
H-Bond Donor
1
What is the molecular formula of [(2,2,8-Trimethyl-4H-1,3-dioxino[4,5-c]pyridin-5-yl)methyl]hydrogen succinate?
The molecular formula is C15H19NO6.
What is the molecular weight of [(2,2,8-Trimethyl-4H-1,3-dioxino[4,5-c]pyridin-5-yl)methyl]hydrogen succinate?
The molecular weight is 309.31 g/mol.
What are some synonyms for [(2,2,8-Trimethyl-4H-1,3-dioxino[4,5-c]pyridin-5-yl)methyl]hydrogen succinate?
Synonyms include BE9ATZ7VUW and UNII-BE9ATZ7VUW.
What is the InChIKey for [(2,2,8-Trimethyl-4H-1,3-dioxino[4,5-c]pyridin-5-yl)methyl]hydrogen succinate?
The InChIKey is QXAWEIDCMROCDU-UHFFFAOYSA-N.
What is the canonical SMILES representation of [(2,2,8-Trimethyl-4H-1,3-dioxino[4,5-c]pyridin-5-yl)methyl]hydrogen succinate?
The canonical SMILES is CC1=NC=C(C2=C1OC(OC2)(C)C)COC(=O)CCC(=O)O.
What is the CAS number for [(2,2,8-Trimethyl-4H-1,3-dioxino[4,5-c]pyridin-5-yl)methyl]hydrogen succinate?
The CAS number is 94108-52-8.
What is the XLogP3-AA value for [(2,2,8-Trimethyl-4H-1,3-dioxino[4,5-c]pyridin-5-yl)methyl]hydrogen succinate?
The XLogP3-AA value is 0.5.
How many hydrogen bond acceptors does [(2,2,8-Trimethyl-4H-1,3-dioxino[4,5-c]pyridin-5-yl)methyl]hydrogen succinate have?
It has 7 hydrogen bond acceptors.
What is the topological polar surface area of [(2,2,8-Trimethyl-4H-1,3-dioxino[4,5-c]pyridin-5-yl)methyl]hydrogen succinate?
The topological polar surface area is 95.2.
How many covalently-bonded units are present in [(2,2,8-Trimethyl-4H-1,3-dioxino[4,5-c]pyridin-5-yl)methyl]hydrogen succinate?
There is 1 covalently-bonded unit in the compound.
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