CAS
906101-33-5 Purity
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906101-33-5 Purity
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6-Dimethylamino-9H-purine-2-sulfonic acid dimethylamide
CAS
90610-93-8
Catalog Number
ACM90610938
Category
Other Products
Molecular Weight
270.311460 [g/mol]
Molecular Formula
C9H14N6O2S
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Specification
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
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
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 Ų.
Is 6-Dimethylamino-9H-purine-2-sulfonic acid dimethylamide a canonicalized compound?
Yes, it is a canonicalized compound.
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