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Structure

2,4,6-Tribromophenyl salicylate

CAS
96-87-7
Catalog Number
ACM96877
Category
Other Products
Molecular Weight
450.905 g/mol
Molecular Formula
C13H7Br3O3

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Specification

Synonyms
EINECS 202-542-5, 2,4,6-Tribromophenyl salicylate, CID66791, 96-87-7
IUPAC Name
(2,4,6-tribromophenyl) 2-hydroxybenzoate
InChI Key
VZWVHUUGXIFDKA-UHFFFAOYSA-N
Boiling Point
522.9ºC at 760mmHg
Flash Point
270.1ºC
Density
2.051g/cm³
Exact Mass
447.79500
H-Bond Acceptor
3
H-Bond Donor
1
What is the IUPAC name of the compound?

The IUPAC name of the compound is (2,4,6-tribromophenyl) 2-hydroxybenzoate.

What is the InChI of the compound?

The InChI of the compound is InChI=1S/C13H7Br3O3/c14-7-5-9(15)12(10(16)6-7)19-13(18)8-3-1-2-4-11(8)17/h1-6,17H.

What is the InChIKey of the compound?

The InChIKey of the compound is VZWVHUUGXIFDKA-UHFFFAOYSA-N.

What is the molecular formula of the compound?

The molecular formula of the compound is C13H7Br3O3.

What is the molecular weight of the compound?

The molecular weight of the compound is 450.90 g/mol.

What is the CAS number of the compound?

The CAS number of the compound is 96-87-7.

What is the EC number of the compound?

The EC number of the compound is 202-542-5.

What is the DSSTox Substance ID of the compound?

The DSSTox Substance ID of the compound is DTXSID50242074.

What is the XLogP3 value of the compound?

The XLogP3 value of the compound is 5.8.

Is the compound canonicalized?

Yes, the compound is canonicalized.

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