Welcome to LookChem.com Sign In|Join Free
  • or
Home > Products >  > 

3-Aminobenzoic acid sodium salt

Related Products

Hot Products

Basic Information Post buying leads Suppliers
Name

3-Aminobenzoic acid sodium salt

EINECS N/A
CAS No. 17264-94-7 Density 1.315 g/cm3
PSA 66.15000 LogP 0.21350
Solubility almost transparency Melting Point N/A
Formula C7H6NNaO2 Boiling Point 352.5 °C at 760 mmHg
Molecular Weight 159.12 Flash Point 167 °C
Transport Information N/A Appearance N/A
Safety Risk Codes N/A
Molecular Structure Molecular Structure of 17264-94-7 (3-Aminobenzoic acid sodium salt) Hazard Symbols N/A
Synonyms

Benzoic acid, 3-amino-, sodium salt (1:1).;

 

3-Aminobenzoic acid sodium salt Specification

The 3-Aminobenzoic acid sodium salt, with the CAS registry number 17264-94-7, is also known as Benzoic acid, 3-amino-, sodium salt (1:1). This chemical's molecular formula is C7H6NNaO2 and molecular weight is 159.12. What's more, its IUPAC name is Sodium 3-aminobenzoate.

Physical properties about 3-Aminobenzoic acid sodium salt are: (1)ACD/LogP: 0.78; (2)# of Rule of 5 Violations: 0; (3)ACD/LogD (pH 5.5): -0.38; (4)ACD/LogD (pH 7.4): -1.97; (5)ACD/BCF (pH 5.5): 1; (6)ACD/BCF (pH 7.4): 1; (7)ACD/KOC (pH 5.5): 4.33; (8)ACD/KOC (pH 7.4): 1; (9)#H bond acceptors: 3; (10)#H bond donors: 3; (11)#Freely Rotating Bonds: 2; (12)Polar Surface Area: 40.54 Å2; (13)Flash Point: 167 °C; (14)Enthalpy of Vaporization: 63.04 kJ/mol; (15)Boiling Point: 352.5 °C at 760 mmHg; (16)Vapour Pressure: 1.41E-05 mmHg at 25 °C.

You can still convert the following datas into molecular structure:
(1) SMILES: [Na+].O=C([O-])c1cc(N)ccc1
(2) InChI: InChI=1/C7H7NO2.Na/c8-6-3-1-2-5(4-6)7(9)10;/h1-4H,8H2,(H,9,10);/q;+1/p-1
(3) InChIKey: BQUBXHVVWRFWJX-REWHXWOFAN

The toxicity data is as follows:

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 intravenous 3270mg/kg (3270mg/kg)   Medicinal Chemistry, A Series of Reviews. Vol. 6, Pg. 343, 1963.
rat LD50 intravenous 2760mg/kg (2760mg/kg)   Proceedings of the Society for Experimental Biology and Medicine. Vol. 49, Pg. 184, 1942.

Post a RFQ

Enter 15 to 2000 letters.Word count: 0 letters

Attach files(File Format: Jpeg, Jpg, Gif, Png, PDF, PPT, Zip, Rar,Word or Excel Maximum File Size: 3MB)

1

What can I do for you?
Get Best Price

Get Best Price for 17264-94-7