6-Dimethylamino-9H-purine-2-sulfonic acid dimethylamide

CAS
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CAS
90610-93-8
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Purity
96%
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Catalog Number

ACM90610938

Product Name

6-Dimethylamino-9H-purine-2-sulfonic acid dimethylamide

Structure

Structure

CAS

90610-93-8

Category

Heterocyclic Organic Compound

Synonyms

NCIOpen2_002526, MolPort-005-935-860, NSC57786, ZINC17315536, CID4288472, AC-17214, 6-Dimethylamino-9H-purine-2-sulfonic acid dimethylamide, 90610-93-8

IUPAC Name

6-(dimethylamino)-N,N-dimethyl-7H-purine-2-sulfonamide

Molecular Weight

270.311460 [g/mol]

Molecular Formula

C9H14N6O2S

Canonical SMILES

CN(C)C1=NC(=NC2=C1NC=N2)S(=O)(=O)N(C)C

InChI Key

NLPMUTNIJWXJOX-UHFFFAOYSA-N

Boiling Point

393.5ºC at 760mmHg

Flash Point

191.8ºC

Density

1.52g/cm³

Exact Mass

270.09000

H-Bond Acceptor

7

H-Bond Donor

1

MSDS

COA

Spec Sheet

Download Spec Sheet

What is the molecular formula of 6-Dimethylamino-9H-purine-2-sulfonic acid dimethylamide?

The molecular formula is C9H14N6O2S.

What is the molecular weight of 6-Dimethylamino-9H-purine-2-sulfonic acid dimethylamide?

The molecular weight is 270.31 g/mol.

What are some synonyms for 6-Dimethylamino-9H-purine-2-sulfonic acid dimethylamide?

Some synonyms include 90610-93-8, 6-(Dimethylamino)-N,N-dimethyl-9H-purine-2-sulfonamide and NCIOpen2_002526.

When was the structure of 6-Dimethylamino-9H-purine-2-sulfonic acid dimethylamide created and modified?

The structure was created on 2005-09-14 and modified on 2023-12-30.

What is the IUPAC name of 6-Dimethylamino-9H-purine-2-sulfonic acid dimethylamide?

The IUPAC name is 6-(dimethylamino)-N,N-dimethyl-7H-purine-2-sulfonamide.

What is the InChI of 6-Dimethylamino-9H-purine-2-sulfonic acid dimethylamide?

The InChI is InChI=1S/C9H14N6O2S/c1-14(2)8-6-7(11-5-10-6)12-9(13-8)18(16,17)15(3)4/h5H,1-4H3,(H,10,11,12,13).

How many hydrogen bond donor counts does 6-Dimethylamino-9H-purine-2-sulfonic acid dimethylamide have?

It has 1 hydrogen bond donor count.

What is the XLogP3-AA value of 6-Dimethylamino-9H-purine-2-sulfonic acid dimethylamide?

The XLogP3-AA value is 0.

What is the topological polar surface area of 6-Dimethylamino-9H-purine-2-sulfonic acid dimethylamide?

The topological polar surface area is 104 Å².

Is 6-Dimethylamino-9H-purine-2-sulfonic acid dimethylamide a canonicalized compound?

Yes, it is a canonicalized compound.

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