2,2-Dimethylsuccinic Anhydride
Product Information
Molecular Formula
C6H8O3
Molecular Weight
128.13
Description
2,2-Dimethylsuccinic Anhydride (CAS# 17347-61-4) is a useful research chemical.
Synonyms
3,3-dimethyloxolane-2,5-dione; 3,3-dimethyloxolane-2,5-dione
IUPAC Name
3,3-dimethyloxolane-2,5-dione
SMILES
CC1(CC(=O)OC1=O)C
InChI
InChI=1S/C6H8O3/c1-6(2)3-4(7)9-5(6)8/h3H2,1-2H3
InChI Key
ACJPFLIEHGFXGP-UHFFFAOYSA-N
Boiling Point
219-220 °C (lit.)
Melting Point
29-31 °C (lit.)
Flash Point
226.4 °CF - closed cup
Purity
98 %
Density
1.135 g/mL at 25 °C (lit.)
LogP
0.48610
Safety Information
Hazards
H315 - H319 - H335
Precautionary Statement
P261, P264, P271, P280, P302+P352, P304+P340, P305+P351+P338, P312, P321, P332+P313, P337+P313, P362, P403+P233, P405, and P501
Signal Word
Warning
Computed Properties
XLogP3
0.5
Hydrogen Bond Donor Count
0
Hydrogen Bond Acceptor Count
3
Rotatable Bond Count
0
Exact Mass
128.047344113 g/mol
Monoisotopic Mass
128.047344113 g/mol
Topological Polar Surface Area
43.4Ų
Heavy Atom Count
9
Formal Charge
0
Complexity
169
Isotope Atom Count
0
Defined Atom Stereocenter Count
0
Undefined Atom Stereocenter Count
0
Defined Bond Stereocenter Count
0
Undefined Bond Stereocenter Count
0
Covalently-Bonded Unit Count
1
Compound Is Canonicalized
Yes
Patents
| Publication Number | Title | Priority Date |
|---|---|---|
| CN-113956323-A | Tetracyclic triterpene derivative and preparation method and application thereof | 2021-11-12 |
| CN-113845559-A | Triptolide derivative and preparation method and application thereof | 2021-11-05 |
| CN-113845481-A | Synthesis method of 4, 4-dimethyl-4, 5-dihydropyridazin-3-one | 2021-10-29 |
| CN-113749977-A | A hair treatment perfume composition with lasting fragrance | 2021-09-24 |
| CN-113072848-A | Water-based woodware anti-expansion bar seal primer and preparation method thereof | 2021-03-26 |
| CN-112385756-A | Preparation method of dendrobium huoshanense primary pulp | 2020-11-16 |
| CN-112300240-A | Hederagenin anhydride derivative and preparation method and application thereof | 2020-11-02 |
| CN-112300240-B | Hederagenin anhydride derivative and preparation method and application thereof | 2020-11-02 |
| WO-2022054737-A1 | Fluorinated carboxylic acid salt compound | 2020-09-08 |
| WO-2022042577-A1 | Preparation method for pyrrolopyrimidine compound | 2020-08-25 |
