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thiochrome diphosphate

CAS 13185-55-2C12H16N4O7P2SMW 422.29

thiochrome diphosphate (CAS 13185-55-2) — formula C12H16N4O7P2S, molecular weight 422.29; category organic chemicals.

Product Overview

CAS Number13185-55-2
Molecular FormulaC12H16N4O7P2S
Molecular Weight422.29
LogP-1.6
CategoryOrganic Chemicals

Technical Profile

What this product is

thiochrome diphosphate is a carbon-based organic compound with CAS registry number 13185-55-2 and molecular formula C12H16N4O7P2S (molecular weight 422.29), belonging to the organic chemicals segment of chemical raw materials.

Identification

CAS number: 13185-55-2

Its molecular formula C12H16N4O7P2S comprises 12 C, 16 H, 4 N, 7 O, 2 P, 1 S atoms.

Also known as: thiochrome diphosphate · 二磷酸硫代铬

Category: organic chemicals

Frequently Asked Questions

What is the CAS number of thiochrome diphosphate?

The CAS registry number of thiochrome diphosphate is 13185-55-2.

What is the molecular formula and molecular weight of thiochrome diphosphate?

Molecular formula C12H16N4O7P2S, molecular weight 422.29.

What other names is thiochrome diphosphate known by?

It is also registered under: thiochrome diphosphate, 二磷酸硫代铬.

Which category does thiochrome diphosphate belong to?

Category: Organic Chemicals.

PubChem Public Data

Independent reference data for thiochrome diphosphate (CAS 13185-55-2), compiled from public chemistry databases.

Registry identifiers across databases

CAS 号13185-55-2
PubChem CID128838
分子式C12H16N4O7P2S
IUPAC 名称2-(6,12-dimethyl-4-thia-2,7,11,13-tetrazatricyclo[7.4.0.03,7]trideca-1(13),2,5,9,11-pentaen-5-yl)ethyl phosphono hydrogen phosphate

Computed descriptors

Molecular Weight422.29
XLogP3-1.6
Hydrogen Bond Donor Count3
Hydrogen Bond Acceptor Count11
Rotatable Bond Count6
Exact Mass422.02149403
Monoisotopic Mass422.02149403
Topological Polar Surface Area180
Heavy Atom Count26

Synonyms and trade names

Thiochrome diphosphate; 13185-55-2; RefChem:189453; 2-(2,7-dimethyl-5h-pyrimido[4,5-d][1,3]thiazolo[3,2-a]pyrimidin-8-yl)ethyl trihydrogen diphosphate; DTXSID10927370; Diphosphoric acid, mono(2-(2,7-dimethyl-5H-pyrimido(4,5-d)thiazolo(3,2-a)pyrimidin-8-yl)ethyl) ester

What the public record says

二磷酸硫代铬 · CAS 13185-55-2 · C12H16N4O7P2S.

Source: PubChem / Wikidata; the batch COA governs where values differ.

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