3,9-Dihydroxy-8-methyl-1,5-dihydro-[1,3,2]dioxaphosphepino[5,6-c]pyridine 3-oxide

Catalog Number	ACM14141470-1
CAS	14141-47-0
Structure
Synonyms	3-Hydroxy-8-methyl-3-oxo-1,5-dihydro-[1,3,2]dioxaphosphepino[5,6-c]pyridin-9-ol
IUPAC Name	3-hydroxy-8-methyl-3-oxo-1,5-dihydro-[1,3,2]dioxaphosphepino[5,6-c]pyridin-9-ol
Molecular Weight	231.14
Molecular Formula	C8H10NO5P
InChI	KCAJHODRYGNBSX-UHFFFAOYSA-N
InChI Key	InChI=1S/C8H10NO5P/c1-5-8(10)7-4-14-15(11,12)13-3-6(7)2-9-5/h2,10H,3-4H2,1H3,(H,11,12)
Boiling Point	479.0±55.0 °C(Predicted)
Purity	98%
Density	1.58±0.1 g/cm3(Predicted)
Isomeric SMILES	CC1=NC=C2COP(=O)(OCC2=C1O)O
pKa	1.05±0.20(Predicted)

Q&A

What is the chemical structure of 3,9-Dihydroxy-8-methyl-1,5-dihydro-[1,3,2]dioxaphosphepino[5,6-c]pyridine 3-oxide?

The chemical structure of 3,9-Dihydroxy-8-methyl-1,5-dihydro-[1,3,2]dioxaphosphepino[5,6-c]pyridine 3-oxide is 3,9-Dihydroxy-8-methyl-1,5-dihydro-[1,3,2]dioxaphosphepino[5,6-c]pyridine 3-oxide.

What is the Canonical SMILES for 3,9-Dihydroxy-8-methyl-1,5-dihydro-[1,3,2]dioxaphosphepino[5,6-c]pyridine 3-oxide?

The Canonical SMILES for 3,9-Dihydroxy-8-methyl-1,5-dihydro-[1,3,2]dioxaphosphepino[5,6-c]pyridine 3-oxide is CC1=NC=C2COP(=O)(OCC2=C1O)O.

What is the CAS number for 3,9-Dihydroxy-8-methyl-1,5-dihydro-[1,3,2]dioxaphosphepino[5,6-c]pyridine 3-oxide?

The CAS number for 3,9-Dihydroxy-8-methyl-1,5-dihydro-[1,3,2]dioxaphosphepino[5,6-c]pyridine 3-oxide is 14141-47-0.

What is the molecular weight of 3,9-Dihydroxy-8-methyl-1,5-dihydro-[1,3,2]dioxaphosphepino[5,6-c]pyridine 3-oxide?

The molecular weight of 3,9-Dihydroxy-8-methyl-1,5-dihydro-[1,3,2]dioxaphosphepino[5,6-c]pyridine 3-oxide is 231.14 g/mol.

How many hydrogen bond acceptors are present in 3,9-Dihydroxy-8-methyl-1,5-dihydro-[1,3,2]dioxaphosphepino[5,6-c]pyridine 3-oxide?

There are 6 hydrogen bond acceptors present in 3,9-Dihydroxy-8-methyl-1,5-dihydro-[1,3,2]dioxaphosphepino[5,6-c]pyridine 3-oxide.

What is the IUPAC name of 3,9-Dihydroxy-8-methyl-1,5-dihydro-[1,3,2]dioxaphosphepino[5,6-c]pyridine 3-oxide?

The IUPAC name of 3,9-Dihydroxy-8-methyl-1,5-dihydro-[1,3,2]dioxaphosphepino[5,6-c]pyridine 3-oxide is 3-hydroxy-8-methyl-3-oxo-1,5-dihydro-[1,3,2]dioxaphosphepino[5,6-c]pyridin-9-ol.

What are some of the synonyms for 3,9-Dihydroxy-8-methyl-1,5-dihydro-[1,3,2]dioxaphosphepino[5,6-c]pyridine 3-oxide?

Some synonyms for 3,9-Dihydroxy-8-methyl-1,5-dihydro-[1,3,2]dioxaphosphepino[5,6-c]pyridine 3-oxide include MRS 2219, Pyridoxine-4,5-cyclic phosphate, and Tocris-1203.

What is the InChIKey for 3,9-Dihydroxy-8-methyl-1,5-dihydro-[1,3,2]dioxaphosphepino[5,6-c]pyridine 3-oxide?

The InChIKey for 3,9-Dihydroxy-8-methyl-1,5-dihydro-[1,3,2]dioxaphosphepino[5,6-c]pyridine 3-oxide is KCAJHODRYGNBSX-UHFFFAOYSA-N.

How many heavy atoms are present in 3,9-Dihydroxy-8-methyl-1,5-dihydro-[1,3,2]dioxaphosphepino[5,6-c]pyridine 3-oxide?

There are 15 heavy atoms present in 3,9-Dihydroxy-8-methyl-1,5-dihydro-[1,3,2]dioxaphosphepino[5,6-c]pyridine 3-oxide.

What is the mono-isotopic mass of 3,9-Dihydroxy-8-methyl-1,5-dihydro-[1,3,2]dioxaphosphepino[5,6-c]pyridine 3-oxide?

The mono-isotopic mass of 3,9-Dihydroxy-8-methyl-1,5-dihydro-[1,3,2]dioxaphosphepino[5,6-c]pyridine 3-oxide is 231.02965942.