CAS
933694-27-0 Purity
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933694-27-0 Purity
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2,4,6,7-Tetrahydropyrano[4,3-c]pyrazole-3-carboxylic acid
CAS
933694-89-4
Catalog Number
ACM933694894
Category
Other Products
Molecular Weight
168.150020 [g/mol]
Molecular Formula
C7H8N2O3
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Specification
Synonyms
1,4,6,7-tetrahydropyrano[4,3-c]pyrazole-3-carboxylic acid, 518990-20-0, 1H,4H,6H,7H-pyrano[4,3-c]pyrazole-3-carboxylic acid, Pyrano[4,3-c]pyrazole-3-carboxylic acid, 1,4,6,7-tetrahydro- (9CI), 933694-89-4, CHEMBL393084, SCHEMBL1807346, CTK4J5056, DTXSID90625968, YICMXCDJSOOXSM-UHFFFAOYSA-N, ANW-54367, MFCD10566785, MFCD15202266, SBB067360, WTI-11437, ZINC28948753, AKOS006305518, AKOS016353097, CS11900, MCULE-7128521170
IUPAC Name
1,4,6,7-tetrahydropyrano[4,3-c]pyrazole-3-carboxylic acid
Canonical SMILES
C1COCC2=C1NN=C2C(=O)O
InChI Key
YICMXCDJSOOXSM-UHFFFAOYSA-N
H-Bond Acceptor
4
H-Bond Donor
2
What is the molecular formula of 2,4,6,7-Tetrahydropyrano[4,3-c]pyrazole-3-carboxylic acid?
The molecular formula is C7H8N2O3.
What is the molecular weight of 2,4,6,7-Tetrahydropyrano[4,3-c]pyrazole-3-carboxylic acid?
The molecular weight is 168.15 g/mol.
What is the IUPAC name of 2,4,6,7-Tetrahydropyrano[4,3-c]pyrazole-3-carboxylic acid?
The IUPAC name is 1,4,6,7-tetrahydropyrano[4,3-c]pyrazole-3-carboxylic acid.
What is the InChIKey of 2,4,6,7-Tetrahydropyrano[4,3-c]pyrazole-3-carboxylic acid?
The InChIKey is YICMXCDJSOOXSM-UHFFFAOYSA-N.
How many hydrogen bond donor counts does 2,4,6,7-Tetrahydropyrano[4,3-c]pyrazole-3-carboxylic acid have?
It has 2 hydrogen bond donor counts.
What is the topological polar surface area of 2,4,6,7-Tetrahydropyrano[4,3-c]pyrazole-3-carboxylic acid?
The topological polar surface area is 75.2 Å2.
What is the formal charge of 2,4,6,7-Tetrahydropyrano[4,3-c]pyrazole-3-carboxylic acid?
The formal charge is 0.
Is 2,4,6,7-Tetrahydropyrano[4,3-c]pyrazole-3-carboxylic acid considered canonicalized?
Yes, it is considered canonicalized.
How many rotatable bond counts does 2,4,6,7-Tetrahydropyrano[4,3-c]pyrazole-3-carboxylic acid have?
It has 1 rotatable bond count.
What is the Isotope Atom Count of 2,4,6,7-Tetrahydropyrano[4,3-c]pyrazole-3-carboxylic acid?
The Isotope Atom Count is 0.
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