Structure

5,5'-Thiodisalicylic Acid

CAS
1820-99-1
Catalog Number
ACM-MO-1820991
Category
Other Products; Dicarboxylic Acid Monomers
Molecular Weight
306.29 g/mol
Molecular Formula
C14H10O6S

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Specification

IUPAC Name
5-(3-carboxy-4-hydroxyphenyl)sulfanyl-2-hydroxybenzoic acid
Canonical SMILES
C1=CC(=C(C=C1SC2=CC(=C(C=C2)O)C(=O)O)C(=O)O)O
InChI
InChI=1S/C14H10O6S/c15-11-3-1-7(5-9(11)13(17)18)21-8-2-4-12(16)10(6-8)14(19)20/h1-6,15-16H,(H,17,18)(H,19,20)
InChI Key
DWMJRSPNFCPIQN-UHFFFAOYSA-N
Appearance
White to Light Yellow Powder to Crystal
Complexity
365
Covalently-Bonded Unit Count
1
Exact Mass
306.019809g/mol
Formal Charge
0
H-Bond Acceptor
7
H-Bond Donor
4
Heavy Atom Count
21
Monoisotopic Mass
306.019809g/mol
Physical State
Solid
Rotatable Bond Count
4
XLogP3
3.4
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