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Structure

6-Cyclopropyl-3-methyl-isoxazolo[5,4-b]pyridine-4-carboxylic acid

CAS
923258-65-5
Catalog Number
ACM923258655
Category
Other Products
Molecular Weight
218.208700 [g/mol]
Molecular Formula
C11H10N2O3

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Specification

Synonyms
SBB023946, 6-cyclopropyl-3-methylisoxazolo[5,4-b]pyridine-4-carboxylic acid, 6-Cyclopropyl-3-methyl-isoxazolo[5,4-b]pyridine-4-carboxylic acid, SureCN461627, AC1Q2QB5, CTK7I7060, MolPort-000-876-831, STK347040, AKOS000263788, AG-A-89966, MCULE-5349288645, AK125261, EN300-24703, T5598127, 6-cyclopropyl-3-methyl-[1,2]oxazolo[5,4-b]pyridine-4-carboxylic acid, 6-cyclopropyl-3-methyl[1,2]oxazolo[5,4-b]pyridine-4-carboxylic acid, 923258-65-5
IUPAC Name
6-cyclopropyl-3-methyl-[1,2]oxazolo[5,4-b]pyridine-4-carboxylic acid
Canonical SMILES
CC1=NOC2=C1C(=CC(=N2)C3CC3)C(=O)O
InChI Key
HAAOEAXJMWXUTF-UHFFFAOYSA-N
Exact Mass
218.06900
H-Bond Acceptor
5
H-Bond Donor
1
What is the molecular formula of 6-Cyclopropyl-3-methyl-isoxazolo[5,4-b]pyridine-4-carboxylic acid?

The molecular formula is C11H10N2O3.

What is the molecular weight of 6-Cyclopropyl-3-methyl-isoxazolo[5,4-b]pyridine-4-carboxylic acid?

The molecular weight is 218.21 g/mol.

What is the IUPAC name of 6-Cyclopropyl-3-methyl-isoxazolo[5,4-b]pyridine-4-carboxylic acid?

The IUPAC name is 6-cyclopropyl-3-methyl-[1,2]oxazolo[5,4-b]pyridine-4-carboxylic acid.

What is the InChI key of 6-Cyclopropyl-3-methyl-isoxazolo[5,4-b]pyridine-4-carboxylic acid?

The InChI key is HAAOEAXJMWXUTF-UHFFFAOYSA-N.

How many hydrogen bond donor counts does 6-Cyclopropyl-3-methyl-isoxazolo[5,4-b]pyridine-4-carboxylic acid have?

It has 1 hydrogen bond donor count.

How many hydrogen bond acceptor counts does 6-Cyclopropyl-3-methyl-isoxazolo[5,4-b]pyridine-4-carboxylic acid have?

It has 5 hydrogen bond acceptor counts.

What is the XLogP3-AA value of 6-Cyclopropyl-3-methyl-isoxazolo[5,4-b]pyridine-4-carboxylic acid?

The XLogP3-AA value is 1.5.

What is the exact mass of 6-Cyclopropyl-3-methyl-isoxazolo[5,4-b]pyridine-4-carboxylic acid?

The exact mass is 218.06914219 g/mol.

How many rotatable bond counts does 6-Cyclopropyl-3-methyl-isoxazolo[5,4-b]pyridine-4-carboxylic acid have?

It has 2 rotatable bond counts.

Is 6-Cyclopropyl-3-methyl-isoxazolo[5,4-b]pyridine-4-carboxylic acid a canonicalized compound?

Yes, it is a canonicalized compound.

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