2-(2-Hydroxy-3,5-di-tert-butylphenyl)-5-chlorobenzotriazole

• CAS: 3864-99-1
• Catalog Number: ACM3864991
• Category: Polymer/Macromolecule
• Molecular Weight: 357.88
• Molecular Formula: C₂₀H₂₄ClN₃O
• Synonyms: 2-(2'-hydroxy-3',5'-ditertbutylphenyl)-5-chloro-benzotrizole;2-(5-chloro-2h-benzotriazol-2-yl)-4,6-bis(1,1-dimethylethyl)-pheno;4-di-tert-butyl-6-(5-chloro-2h-benzo-triazol-2-;Phenol,2-(5-chloro-2H-benzotriazol-2-yl)-4,6-bis(1,1-dimethylethyl)-;5-CHLORO-2
• IUPAC Name: 2,4-ditert-butyl-6-(5-chlorobenzotriazol-2-yl)phenol
• Canonical SMILES: CC(C)(C)C1=CC(=C(C(=C1)N2N=C3C=CC(=CC3=N2)Cl)O)C(C)(C)C
• InChI Key: UWSMKYBKUPAEJQ-UHFFFAOYSA-N
• Boiling Point: 469.2ºC at 760 mmHg
• Melting Point: 150-158ºC
• Flash Point: 237.6ºC
• Density: 1.26
• Appearance: Slightly yellowish powder
• EC Number: 223-383-8
• Exact Mass: 357.16100
• Hazard Statements: Xi:Irritant
• H-Bond Acceptor: 4
• H-Bond Donor: 1
• Safety Description: S26-S36
• WGK Germany: 2

Custom Q&A

What is the molecular formula of 5-Chloro-2-(3,5-di-tert-butyl-2-hydroxyphenyl)-2H-benzotriazole?

The molecular formula is C20H24ClN3O.

What is the molecular weight of the compound?

The molecular weight is 357.9 g/mol.

What is the IUPAC name of the compound?

The IUPAC name is 2,4-ditert-butyl-6-(5-chlorobenzotriazol-2-yl)phenol.

What is the InChI of the compound?

The InChI is InChI=1S/C20H24ClN3O/c1-19(2,3)12-9-14(20(4,5)6)18(25)17(10-12)24-22-15-8-7-13(21)11-16(15)23-24/h7-11,25H,1-6H3.

What is the InChIKey of the compound?

The InChIKey is UWSMKYBKUPAEJQ-UHFFFAOYSA-N.

What is the canonical SMILES of the compound?

The canonical SMILES is CC(C)(C)C1=CC(=C(C(=C1)N2N=C3C=CC(=CC3=N2)Cl)O)C(C)(C)C.

What is the molecular weight of the compound according to PubChem?

The molecular weight is 357.1607901 g/mol.

How many hydrogen bond donor counts are there in the compound?

There is 1 hydrogen bond donor count.

What is the topological polar surface area of the compound?

The topological polar surface area is 50.9 Ų.

What is the complexity of the compound?

The complexity is 473.