CAS
95310-94-4 Purity
96%
95310-94-4 Purity
96%
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2-(2-Sulfosulfanylethylamino)ethylbenzene
CAS
953-22-0
Catalog Number
ACM953220
Category
Other Products
Molecular Weight
261.361 g/mol
Molecular Formula
C10H15NO3S2
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What is the molecular formula of the compound with PubChem CID 70376?
The molecular formula is C10H15NO3S2.
What is the molecular weight of the compound?
The molecular weight is 261.4 g/mol.
What is the IUPAC name of the compound?
The IUPAC name is 2-(2-sulfosulfanylethylamino)ethylbenzene.
What is the InChI of the compound?
The InChI is InChI=1S/C10H15NO3S2/c12-16(13,14)15-9-8-11-7-6-10-4-2-1-3-5-10/h1-5,11H,6-9H2,(H,12,13,14).
What is the InChIKey of the compound?
The InChIKey is OPXLJUFZIAHIOA-UHFFFAOYSA-N.
What is the Canonical SMILES of the compound?
The Canonical SMILES is C1=CC=C(C=C1)CCNCCSS(=O)(=O)O.
What is the CAS number of the compound?
The CAS number is 953-22-0.
How many hydrogen bond donor counts does the compound have?
The compound has 2 hydrogen bond donor counts.
What is the XLogP3-AA value of the compound?
The XLogP3-AA value is -1.2.
Is the compound's structure canonicalized?
Yes, the compound's structure is canonicalized according to PubChem.
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