CAS
99346-47-1 Purity
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99346-47-1 Purity
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Oxodihydrothiochrome
CAS
99352-94-0
Catalog Number
ACM99352940
Category
Other Products
Molecular Formula
C12H14N4O2S
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Specification
Density
1.5g/cm³
What is the molecular formula of Oxodihydrothiochrome?
The molecular formula of Oxodihydrothiochrome is C12H14N4O2S.
When was Oxodihydrothiochrome first created and modified?
Oxodihydrothiochrome was first created on August 9, 2005, and modified on December 30, 2023.
What is the IUPAC name of Oxodihydrothiochrome?
The IUPAC name of Oxodihydrothiochrome is 5-(2-hydroxyethyl)-6,12-dimethyl-4-thia-2,7,11,13-tetrazatricyclo[7.4.0.03,7]trideca-1(13),5,9,11-tetraen-8-one.
What is the InChIKey of Oxodihydrothiochrome?
The InChIKey of Oxodihydrothiochrome is SFFBMQWMODQHNO-UHFFFAOYSA-N.
What is the canonical SMILES representation of Oxodihydrothiochrome?
The canonical SMILES representation of Oxodihydrothiochrome is CC1=C(SC2N1C(=O)C3=CN=C(N=C3N2)C)CCO.
What is the XLogP3-AA value of Oxodihydrothiochrome?
The XLogP3-AA value of Oxodihydrothiochrome is 0.8.
How many hydrogen bond donor counts does Oxodihydrothiochrome have?
Oxodihydrothiochrome has 2 hydrogen bond donor counts.
What is the topological polar surface area of Oxodihydrothiochrome?
The topological polar surface area of Oxodihydrothiochrome is 104?2.
How many heavy atom counts does Oxodihydrothiochrome have?
Oxodihydrothiochrome has 19 heavy atom counts.
Is Oxodihydrothiochrome considered canonicalized?
Yes, Oxodihydrothiochrome is considered canonicalized according to PubChem.
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