CAS
93776-72-8 Purity
96%
93776-72-8 Purity
96%
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Calcium 2,5-dimethyl-3,4-dithioxoadipate
CAS
93776-78-4
Catalog Number
ACM93776784
Category
Other Products
Molecular Weight
272.354720 [g/mol]
Molecular Formula
C8H8CaO4S2
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Specification
Synonyms
EINECS 298-004-2, Calcium 2,5-dimethyl-3,4-dithioxoadipate, 93776-78-4
IUPAC Name
calcium 2,5-dimethyl-3,4-bis(sulfanylidene)hexanedioate
InChI Key
ADRVTASORWAZLS-UHFFFAOYSA-L
Exact Mass
271.94900
H-Bond Acceptor
4
H-Bond Donor
0
What is the molecular formula of Calcium 2,5-dimethyl-3,4-dithioxoadipate?
The molecular formula is C8H8CaO4S2.
When was Calcium 2,5-dimethyl-3,4-dithioxoadipate created and modified in PubChem?
It was created on 2005-08-08 and modified on 2023-12-30.
What is the IUPAC name of Calcium 2,5-dimethyl-3,4-dithioxoadipate?
The IUPAC name is calcium;2,5-dimethyl-3,4-bis(sulfanylidene)hexanedioate.
What is the InChIKey of Calcium 2,5-dimethyl-3,4-dithioxoadipate?
The InChIKey is ADRVTASORWAZLS-UHFFFAOYSA-L.
What is the Canonical SMILES representation of Calcium 2,5-dimethyl-3,4-dithioxoadipate?
The Canonical SMILES is CC(C(=S)C(=S)C(C)C(=O)[O-])C(=O)[O-].[Ca+2].
What is the molecular weight of Calcium 2,5-dimethyl-3,4-dithioxoadipate?
The molecular weight is 272.4 g/mol.
What is the CAS number of Calcium 2,5-dimethyl-3,4-dithioxoadipate?
The CAS number is 93776-78-4.
How many hydrogen bond acceptor counts does Calcium 2,5-dimethyl-3,4-dithioxoadipate have?
It has 6 hydrogen bond acceptor counts.
What is the topological polar surface area of Calcium 2,5-dimethyl-3,4-dithioxoadipate?
The topological polar surface area is 144 Ų.
Is the compound canonicalized in PubChem?
Yes, the compound is canonicalized in PubChem.
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93776-77-3 Purity
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93776-77-3 Purity
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93776-79-5 Purity
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93776-79-5 Purity
96%
