Cis,cis-1,3,5-cyclohexanetricarboxylic acid

CAS

16526-68-4

Catalog Number

ACM16526684

Category

Polymer/Macromolecule

Molecular Weight

216.19

Molecular Formula

C₉H₁₂O₆

MSDS COA Spec Sheet

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Specification

Synonyms

CIS-1,3,5-CYCLOHEXANETRICARBOXYLIC ACID;CIS,CIS-1,3,5-CYCLOHEXANETRICARBOXYLIC ACID;1,3,5-CYCLOHEXANETRICARBOXYLIC ACID;(1ALPHA,3ALPHA,5ALPHA)-1,3,5-CYCLOHEXANETRICARBOXYLIC ACID;CIS,CIS-1,3,5-CYCLOHEXANETRICARBOXYLIC;1,3,5-CYCLOHEXANETRICARBOXYLIC ACID,

IUPAC Name

cyclohexane-1,3,5-tricarboxylic acid

Canonical SMILES

C1C(CC(CC1C(=O)O)C(=O)O)C(=O)O

InChI Key

FTHDNRBKSLBLDA-UHFFFAOYSA-N

Boiling Point

372.4ºC at 760 mmHg

Melting Point

216-220ºC

Flash Point

193.2ºC

Density

1.509 g/cm³

Exact Mass

216.06300

Hazard Statements

Xi: Irritant;

H-Bond Acceptor

H-Bond Donor

Safety Description

26-36

What is the molecular formula of cis,cis-1,3,5-cyclohexanetricarboxylic acid?

The molecular formula of cis,cis-1,3,5-cyclohexanetricarboxylic acid is C9H12O6.

What is the molecular weight of cis,cis-1,3,5-cyclohexanetricarboxylic acid?

The molecular weight of cis,cis-1,3,5-cyclohexanetricarboxylic acid is 216.19 g/mol.

What is the IUPAC name of cis,cis-1,3,5-cyclohexanetricarboxylic acid?

The IUPAC name of cis,cis-1,3,5-cyclohexanetricarboxylic acid is cyclohexane-1,3,5-tricarboxylic acid.

What is the InChI of cis,cis-1,3,5-cyclohexanetricarboxylic acid?

The InChI of cis,cis-1,3,5-cyclohexanetricarboxylic acid is InChI=1S/C9H12O6/c10-7(11)4-1-5(8(12)13)3-6(2-4)9(14)15/h4-6H,1-3H2,(H,10,11)(H,12,13)(H,14,15).

What is the InChIKey of cis,cis-1,3,5-cyclohexanetricarboxylic acid?

The InChIKey of cis,cis-1,3,5-cyclohexanetricarboxylic acid is FTHDNRBKSLBLDA-UHFFFAOYSA-N.

What is the canonical SMILES of cis,cis-1,3,5-cyclohexanetricarboxylic acid?

The canonical SMILES of cis,cis-1,3,5-cyclohexanetricarboxylic acid is C1C(CC(CC1C(=O)O)C(=O)O).

What is the CAS number of cis,cis-1,3,5-cyclohexanetricarboxylic acid?

The CAS number of cis,cis-1,3,5-cyclohexanetricarboxylic acid is 25357-95-3.

How many hydrogen bond donor count does cis,cis-1,3,5-cyclohexanetricarboxylic acid have?

cis,cis-1,3,5-cyclohexanetricarboxylic acid has 3 hydrogen bond donor count.

How many hydrogen bond acceptor count does cis,cis-1,3,5-cyclohexanetricarboxylic acid have?

cis,cis-1,3,5-cyclohexanetricarboxylic acid has 6 hydrogen bond acceptor count.

How many rotatable bond count does cis,cis-1,3,5-cyclohexanetricarboxylic acid have?

cis,cis-1,3,5-cyclohexanetricarboxylic acid has 3 rotatable bond count.