CAS
93904-90-6 Purity
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93904-90-6 Purity
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Cumenedisulfonic acid
CAS
93904-94-0
Catalog Number
ACM93904940
Category
Other Products
Molecular Weight
280.317980 [g/mol]
Molecular Formula
C9H12O6S2
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Specification
Synonyms
CUMENEDISULFONIC ACID, 93904-94-0, CTK5H3870, AG-H-84782
IUPAC Name
3-propan-2-ylbenzene-1,2-disulfonic acid
Canonical SMILES
CC(C)C1=C(C(=CC=C1)S(=O)(=O)O)S(=O)(=O)O
InChI Key
NZDMEVRRRUTNMT-UHFFFAOYSA-N
Density
1.549g/cm³
EC Number
299-829-0
Exact Mass
280.00800
H-Bond Acceptor
6
H-Bond Donor
2
What is the molecular formula of Cumenedisulfonic acid?
The molecular formula of Cumenedisulfonic acid is C9H12O6S2.
When was Cumenedisulfonic acid created in PubChem?
Cumenedisulfonic acid was created in PubChem on December 5, 2007.
What is the molecular weight of Cumenedisulfonic acid?
The molecular weight of Cumenedisulfonic acid is 280.3 g/mol.
What is the Canonical SMILES representation of Cumenedisulfonic acid?
The Canonical SMILES representation of Cumenedisulfonic acid is CC(C)C1=C(C(=CC=C1)S(=O)(=O)O)S(=O)(=O)O.
What is the CAS number for Cumenedisulfonic acid?
The CAS number for Cumenedisulfonic acid is 93904-94-0.
How many hydrogen bond donor counts does Cumenedisulfonic acid have?
Cumenedisulfonic acid has 2 hydrogen bond donor counts.
What is the XLogP3-AA value of Cumenedisulfonic acid?
The XLogP3-AA value of Cumenedisulfonic acid is 0.5.
What is the Topological Polar Surface Area of Cumenedisulfonic acid?
The Topological Polar Surface Area of Cumenedisulfonic acid is 126 Ų.
Is Cumenedisulfonic acid a canonicalized compound in PubChem?
Yes, Cumenedisulfonic acid is a canonicalized compound in PubChem.
How many rotatable bond counts does Cumenedisulfonic acid have?
Cumenedisulfonic acid has 3 rotatable bond counts.
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CAS
93904-91-7 Purity
96%
93904-91-7 Purity
96%
CAS
93905-00-1 Purity
96%
93905-00-1 Purity
96%
