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Zinc,bis[N,N-bis(phenylmethyl)carbamodithioat ( CASNO:14726-36-4 )
Identification and Related Records
- Zinc,bis[N,N-bis(phenylmethyl)carbamodithioato-kS,kS']-, (T-4)-
- CAS Registry number:
- Zinc,bis(dibenzyldithiocarbamato)- (7CI,8CI)
Zinc,bis[bis(phenylmethyl)carbamodithioato-kS,kS']-, (T-4)- (9CI)
- Molecular Formula:
- Molecular Weight:
- Canonical SMILES:
Chemical and Physical Properties
- white to off-white powder
- Melting Point:
- Boiling Point:
- 7.06E-07mmHg at 25°C
- Flash Point:
- Stable at room temperature in closed containers under normal storage and handling conditions.
- Storage temp:
- Store in a tightly closed container. Store in a cool, dry, well-ventilated area away from incompatible substances.
- Computed Properties:
- Molecular Weight:610.22572 [g/mol]
Rotatable Bond Count:8
Topological Polar Surface Area:72.7
Heavy Atom Count:37
Isotope Atom Count:0
Defined Atom Stereocenter Count:0
Undefined Atom Stereocenter Count:0
Defined Bond Stereocenter Count:0
Undefined Bond Stereocenter Count:0
Covalently-Bonded Unit Count:3
Safety and Handling
- Risk Statements:
- Safety Statements:
- The Zinc dibenzyldithiocarbamate , with cas registry number of 14726-36-4, also has other registry numbers including 137427-50-0, 138-54-5, 56803-46-4. It has other synonyms like Dibenzyldithiocarbamic acid zinc salt ; Zinc bis(N,N-dibenzyldithiocarbamate) . Its IUPAC name is called zinc N,N-dibenzylcarbamodithioate . The systematic name is named as zinc bis(dibenzylcarbamodithioate) . It belongs to the categories of (1)Organometallics; (2)Classes of Metal Compounds; (3)Transition Metal Compounds; (4)Zn (Zinc) Compounds. Physical properties of Zinc dibenzyldithiocarbamate are: (1) ACD/LogP: 4.25 ; (2) # of Rule of 5 Violations: 0 ; (3) ACD/LogD (pH 5.5): 1.55 ; (4) ACD/LogD (pH 7.4): 0.55 ; (5) ACD/BCF (pH 5.5): 2 ; (6) ACD/BCF (pH 7.4): 1 ; (7) ACD/KOC (pH 5.5): 9.78 ; (8) ACD/KOC (pH 7.4): 1 ; (9) #H bond acceptors: 1 ; (10) #H bond donors: 0 ; (11) #Freely Rotating Bonds: 4 ; (12) Enthalpy of Vaporization: 66.03 kJ/mol ; (13) Vapour Pressure: 7.06E-07 mmHg at 25°C. When you are using this chemical, please be cautious about it as the following:
The Zinc dibenzyldithiocarbamate irritates to eyes, respiratory system and skin. During use it, avoid contact with skin and eyes. You can still convert the following datas into molecular structure:
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