2-[bis(dimethylamino)phosphoryl]-5-(4-chlorophenyl)-1,2,4-triazol-3-amine

Modify Date: 2025-10-02 21:41:03

2-[bis(dimethylamino)phosphoryl]-5-(4-chlorophenyl)-1,2,4-triazol-3-amine Structure
2-[bis(dimethylamino)phosphoryl]-5-(4-chlorophenyl)-1,2,4-triazol-3-amine structure
 Common Name 2-[bis(dimethylamino)phosphoryl]-5-(4-chlorophenyl)-1,2,4-triazol-3-amine
CAS Number 78218-51-6 Molecular Weight 328.73800
Density 1.42g/cm3 Boiling Point 492.8ºC at 760 mmHg
Molecular Formula C12H18ClN6OP Melting Point N/A
MSDS N/A Flash Point 251.8ºC

 Names

Name 2-[bis(dimethylamino)phosphoryl]-5-(4-chlorophenyl)-1,2,4-triazol-3-amine
Synonym More Synonyms

 Chemical & Physical Properties

Density 1.42g/cm3
Boiling Point 492.8ºC at 760 mmHg
Molecular Formula C12H18ClN6OP
Molecular Weight 328.73800
Flash Point 251.8ºC
Exact Mass 328.09700
PSA 90.82000
LogP 2.19020
Index of Refraction 1.649
InChIKey LUNQNSWPZFTKNH-UHFFFAOYSA-N
SMILES CN(C)P(=O)(N(C)C)n1nc(-c2ccc(Cl)cc2)nc1N

 Toxicological Information

CHEMICAL IDENTIFICATION

RTECS NUMBER :
TA1328000
CHEMICAL NAME :
Phosphonic diamide, (5-amino-3-p-chlorophenyl-1H-1,2,4-triazol-1-yl)-N,N, N',N'-tetramethyl
CAS REGISTRY NUMBER :
78218-51-6
BEILSTEIN REFERENCE NO. :
0831602
LAST UPDATED :
199612
DATA ITEMS CITED :
1
MOLECULAR FORMULA :
C12-H18-Cl-N6-O-P
MOLECULAR WEIGHT :
328.78
WISWESSER LINE NOTATION :
T5NN DNJ APO&N1&1&N1&1 CR DG& EZ

HEALTH HAZARD DATA

ACUTE TOXICITY DATA

TYPE OF TEST :
LD50 - Lethal dose, 50 percent kill
ROUTE OF EXPOSURE :
Oral
SPECIES OBSERVED :
Rodent - mouse
DOSE/DURATION :
10 mg/kg
TOXIC EFFECTS :
Details of toxic effects not reported other than lethal dose value
REFERENCE :
RTCPA3 Recueil des Travaux Chimiques des Pays-Bas. Journal of the Royal Netherlands Chemical Society. (The Hague, Netherlands) V.1-98, 1882-1979. Volume(issue)/page/year: 79,807,1960

 Synonyms

WP177
3-Amino-x-<bis-dimethylamido-phosphoryl>-5-<4-chlor-phenyl>-1.2.4-triazol
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Chemsrc provides CAS#:78218-51-6 MSDS, density, melting point, boiling point, structure, etc. Its name is 2-[bis(dimethylamino)phosphoryl]-5-(4-chlorophenyl)-1,2,4-triazol-3-amine>> amp version: 2-[bis(dimethylamino)phosphoryl]-5-(4-chlorophenyl)-1,2,4-triazol-3-amine

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