Basic information
- CAS
3720-55-6- Standard SMILES
N#CC(C#N)=NNc1ccc(Cl)c(Cl)c1- InChIKey
GTVGGHQLKNCAMB-UHFFFAOYSA-N- Molecular formula
- C9H4Cl2N4
- Average molar mass
- 239.06 g/mol
- Monoisotopic mass
- 237.9813015
Names & identifiers
- Preferred name
- Propanedinitrile, ((3,4-dichlorophenyl)hydrazono)-
- IUPAC
- 2-[(3,4-dichlorophenyl)hydrazinylidene]propanedinitrile
- English name
- Propanedinitrile, ((3,4-dichlorophenyl)hydrazono)-
- Molecular formula
- C9H4Cl2N4
- Molecular weight
- 239.06
Names & synonyms
3720-55-6BRN 1842625Propanedinitrile, ((3,4-dichlorophenyl)hydrazono)-Mesoxalonitrile, (3,4-dichlorophenyl)hydrazone((3,4-Dichlorophenyl)hydrazono)propanedinitrileDTXSID70190700RefChem:374370DTXCID70113191[(3,4-dichlorophenyl)hydrazono]malononitrile2-[(3,4-Dichlorophenyl)hydrazono]malononitrile2-[(3,4-dichlorophenyl)-hydrazono]malononitrile(3,4-dichlorophenyl)carbonohydrazonoyl dicyanide
Show more names
2-[(3,4-DICHLORO-PHENYL)-HYDRAZONO]-MALONONITRILEPropanedinitrile, 2-[2-(3,4-dichlorophenyl)hydrazinylidene]-
SCHEMBL922333AKOS0026633062-[(3,4-Dichlorophenyl)hydrazono]malononitrile #AF-399/32974029Propanedinitrile, 2-(3,4-dichlorophenylhydrazono)-
Database identifiers
- CAS
3720-55-6- PubChem CID
- 77308
- DTXSID
DTXSID70190700- EC Number
- 151-381-6
Properties
Computed structural properties
- XLogP
- 4.8
- Topological polar surface area
- 72 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 2
- Heavy atoms
- 15
- Formal charge
- 0
- Complexity
- 330
Experimental & physicochemical properties
LogP3.42
Physicochemical properties
- Melting point
- 187 · 187-190 °C
- Boiling point
- 348 · 348.0±52.0 °C(Predicted)
- Density
- 1.4 · 1.40±0.1 g/cm3(Predicted)
- pka
- 5.3 · 5.30±0.10(Predicted)
Safety & regulation
Safety information is for reference only and does not replace the supplier’s Safety Data Sheet (SDS), applicable regulations, or professional assessment.
GHS classification
GHS Classification
H413 (100%): May cause long lasting harmful effects to aquatic life [Hazardous to the aquatic environment, long-term hazard]
P273, and P501 (click each P-code to see the statement)
The GHS information provided by 1 company from 1 notification to the ECHA C&L Inventory.
Hazard information
Hazard Classes and CategoriesAquatic Chronic 4 (100%)
Chemistry & industry
Suppliers1 total
西格玛奥德里奇（上海）贸易有限公司21-20338288 · [email protected]
Related reactions
3 records
Compound notes
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