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1,4-Dihydro-chromeno[4,3-c]pyrazole-3-carboxylic acid

Catalog Number
ACMA00002210
Category
Ethers
Molecular Weight
216.19
Molecular Formula
C12H24N2O2

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Specification

Hazard Statements
H302-H317
RIDADR
NONH for all modes of transport
Symbol
GHS07
What is the molecular formula of 1,4-dihydro-chromeno[4,3-c]pyrazole-3-carboxylic acid?

The molecular formula is C11H8N2O3.

What is the molecular weight of 1,4-dihydro-chromeno[4,3-c]pyrazole-3-carboxylic acid?

The molecular weight is 216.19 g/mol.

What is the IUPAC name of 1,4-dihydro-chromeno[4,3-c]pyrazole-3-carboxylic acid?

The IUPAC name is 2,4-dihydrochromeno[4,3-c]pyrazole-3-carboxylic acid.

What is the InChI of 1,4-dihydro-chromeno[4,3-c]pyrazole-3-carboxylic acid?

The InChI is InChI=1S/C11H8N2O3/c14-11(15)10-7-5-16-8-4-2-1-3-6(8)9(7)12-13-10/h1-4H,5H2,(H,12,13)(H,14,15).

What is the InChIKey of 1,4-dihydro-chromeno[4,3-c]pyrazole-3-carboxylic acid?

The InChIKey is LCCZBCRICIYZCV-UHFFFAOYSA-N.

What is the canonical SMILES of 1,4-dihydro-chromeno[4,3-c]pyrazole-3-carboxylic acid?

The canonical SMILES is C1C2=C(NN=C2C3=CC=CC=C3O1)C(=O)O.

What is the XLogP3-AA value of 1,4-dihydro-chromeno[4,3-c]pyrazole-3-carboxylic acid?

The XLogP3-AA value is 1.3.

How many hydrogen bond donor counts does 1,4-dihydro-chromeno[4,3-c]pyrazole-3-carboxylic acid have?

It has 2 hydrogen bond donor counts.

How many hydrogen bond acceptor counts does 1,4-dihydro-chromeno[4,3-c]pyrazole-3-carboxylic acid have?

It has 4 hydrogen bond acceptor counts.

How many rotatable bond counts does 1,4-dihydro-chromeno[4,3-c]pyrazole-3-carboxylic acid have?

It has 1 rotatable bond count.

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