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
Canonical 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
The molarity calculator equation

Mass (g) = Concentration (mol/L) × Volume (L) × Molecular Weight (g/mol)

The dilution calculator equation

Concentration (start) × Volume (start) = Concentration (final) × Volume (final)

This equation is commonly abbreviated as: C1V1 = C2V2

Related Products

Online Inquiry
  • Verification code
USA
  • International:
  • US & Canada (Toll free):
  • Email:
  • Fax:
UK
  • Email:
Copyright © 2024 BOC Sciences. All rights reserved.
Inquiry Basket