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

5-(2-Amino-4-chlorophenyl)tetrazole

Related Products

Hot Products

Name

5-(2-Amino-4-chlorophenyl)tetrazole

EINECS 258-923-1
CAS No. 54013-18-2 Density 1.54 g/cm3
PSA 80.48000 LogP 1.68350
Solubility N/A Melting Point N/A
Formula C7H6ClN5 Boiling Point 436.5 °C at 760 mmHg
Molecular Weight 195.611 Flash Point 217.8 °C
Transport Information N/A Appearance N/A
Safety Risk Codes N/A
Molecular Structure Molecular Structure of 54013-18-2 (5-chloro-2-(1H-tetrazol-5-yl)aniline) Hazard Symbols N/A
Synonyms

Benzenamine,5-chloro-2-(1H-tetrazol-5-yl)- (9CI);5-(2-Amino-4-chlorophenyl)-1H-tetrazole;5-(2-Amino-4-chlorophenyl)tetrazole;5-Chloro-2-(1H-tetrazol-5-yl)aniline;5-Chloro-2-(1H-tetrazol-5-yl)phenylamine;

Article Data 7

5-(2-Amino-4-chlorophenyl)tetrazole Specification

The IUPAC name of 5-(2-Amino-4-chlorophenyl)tetrazole is 5-Chloro-2-(2H-tetrazol-5-yl)aniline. With the CAS registry number 54013-18-2, it is also named as 5-(2-Amino-4-chlorophenyl)-1H-tetrazole. The product's molecular formula is C7H6ClN5 and its molecular weight is 195.61. 

The other characteristics of 5-(2-Amino-4-chlorophenyl)tetrazole can be summarized as: (1)EINECS: 258-923-1; (2)ACD/LogP: 2.46; (3)# of Rule of 5 Violations: 0; (4)ACD/LogD (pH 5.5): 0.89; (5)ACD/LogD (pH 7.4): 0.46; (6)ACD/BCF (pH 5.5): 1.18; (7)ACD/BCF (pH 7.4): 1; (8)ACD/KOC (pH 5.5): 14.02; (9)ACD/KOC (pH 7.4): 5.27; (10)H bond acceptors: 5; (11)H bond donors: 3; (12)Freely Rotating Bonds: 2; (13)Polar Surface Area: 46.84 Å2; (14)Index of Refraction: 1.692; (15)Molar Refractivity: 48.68 cm3; (16)Molar Volume: 126.9 cm3; (17)Polarizability: 19.29×10-24cm3; (18)Surface Tension: 84 dyne/cm; (19)Density: 1.54 g/cm3; (20)Flash Point: 217.8 °C; (21)Enthalpy of Vaporization: 69.3 kJ/mol; (22)Boiling Point: 436.5 °C at 760 mmHg; (23)Vapour Pressure: 8.02E-08 mmHg at 25 °C.

People can use the following data to convert to the molecule structure.
(1)SMILES:Clc2cc(c(c1nnnn1)cc2)N
(2)InChI:InChI=1/C7H6ClN5/c8-4-1-2-5(6(9)3-4)7-10-12-13-11-7/h1-3H,9H2,(H,10,11,12,13)
(3)InChIKey:KKTZHFZXGZLTLZ-UHFFFAOYAK
(4)Std. InChI:InChI=1S/C7H6ClN5/c8-4-1-2-5(6(9)3-4)7-10-12-13-11-7/h1-3H,9H2,(H,10,11,12,13)
(5)Std. InChIKey:KKTZHFZXGZLTLZ-UHFFFAOYSA-N

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 54013-18-2