| CAS Number | 135788-08-8 |
| Catalog Number | AG0080F1(AGN-PC-09TFP5) |
| Chemical Name | 2,3-bis(4-chlorophenyl)-5-phenyl-2,3-dihydro-1H-1,2,3,4-tetrazol-1-ium chloride |
| IUPAC Name | 2,3-bis(4-chlorophenyl)-5-phenyltetrazol-2-ium;chloride |
| InChI | InChI=1S/C19H13Cl2N4.ClH/c20-15-6-10-17(11-7-15)24-22-19(14-4-2-1-3-5-14)23-25(24)18-12-8-16(21)9-13-18;/h1-13H;1H/q+1;/p-1 |
| InChI Key | AUTAPTQTFVZDGP-UHFFFAOYSA-M |
| MDL Number | MFCD00060008 |
| Molecular Formula | C19H15Cl3N4 |
| Molecular Weight | 405.7082 |
| SMILES | [Cl-].Clc1ccc(cc1)N1[NH2+]C(=NN1c1ccc(Cl)cc1)c1ccccc1 |
| Synonyms | 135788-08-8,
2,3-Bis(4-chlorophenyl)-5-phenyltetrazolium Chloride,
2,3-Bis(4-chlorophenyl)-5-phenyl-2H-tetrazol-3-ium chloride,
SCHEMBL917937,
MFCD00060008,
B1052,
FT-0761008,
C-44681,
J-006775,
2,3-bis(4-chlorophenyl)-5-phenyltetrazol-2-ium;chloride,
AUTAPTQTFVZDGP-UHFFFAOYSA-M,
|
| Complexity | 386 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 2 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 402.021g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 26 |
| Hydrogen Bond Acceptor Count | 3 |
| Hydrogen Bond Donor Count | 0 |
| Isotope Atom Count | 0 |
| Molecular Weight | 403.691g/mol |
| Monoisotopic Mass | 402.021g/mol |
| Rotatable Bond Count | 3 |
| Topological Polar Surface Area | 34.6A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
GHS Hazard and Precautionary Statements
| Symbol: | |
|
Hazard statements
|
|
|
Precautionary statements
|
|
Certificate of Analysis
Lot Number