N,N-Dibenzylthiobenzamide
Basic information
- CAS
61821-51-0- Standard SMILES
S=C(c1ccccc1)N(Cc1ccccc1)Cc1ccccc1- InChIKey
UEOFECQMBDNUQK-UHFFFAOYSA-N- Molecular formula
- C21H19NS
- Average molar mass
- 317.4 g/mol
- Monoisotopic mass
- 317.12382078
Names & identifiers
- Preferred name
- N,N-Dibenzylthiobenzamide
- IUPAC
- N,N-dibenzylbenzenecarbothioamide
- English name
- N,N-dibenzylbenzenecarbothioamide
- Molecular formula
- C21H19NS
- Molecular weight
- 317.45
Names & synonyms
N,N-DIBENZYLTHIOBENZAMIDERefChem:822216653-520-0N,N-dibenzylbenzenecarbothioamide61821-51-0Benzenecarbothioamide, N,N-bis(phenylmethyl)-DTXSID00399183AKOS024333442
Database identifiers
- CAS
61821-51-0- PubChem CID
- 4089421
- DTXSID
DTXSID00399183- EC Number
- 653-520-0
Properties
Computed structural properties
- XLogP
- 5
- Topological polar surface area
- 35.3 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 1
- Rotatable bonds
- 5
- Heavy atoms
- 23
- Formal charge
- 0
- Complexity
- 329
Physicochemical properties
- Symbol(GHS)
- 9 · GHS09
- Signal word
- Warning
- Hazard statements
- 410 · H410
- Precautionary statements
- 273 · P273-P391-P501
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
Warning
H400 (100%): Very toxic to aquatic life [Warning Hazardous to the aquatic environment, acute hazard]
P273, P391, and P501 (click each P-code to see the statement)
Aggregated GHS information provided per 38 reports by companies from 1 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.
Hazard information
Hazard Classes and CategoriesAquatic Acute 1 (100%)
Safety data
- Signal word
- Warning
- Symbol(GHS)
- GHS09
- Hazard statements
- H410
- Precautionary statements
- P273-P391-P501
Suppliers
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Related reactions
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Compound notes
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