Basic information
- CAS
63148-78-7- Standard SMILES
O=CNNc1ccc(NC(=S)Nc2ccccc2)cc1- InChIKey
SKDQTLDBZMLKQA-UHFFFAOYSA-N- Molecular formula
- C14H14N4OS
- Average molar mass
- 286.35 g/mol
- Monoisotopic mass
- 286.08883207
Names & identifiers
- Preferred name
- Thiourea, N-[4-(2-formylhydrazinyl)phenyl]-N'-phenyl-
- IUPAC
- N-[4-(phenylcarbamothioylamino)anilino]formamide
- English name
- N-[4-(2-Formylhydrazino)phenyl]-N'-phenylthiourea
- Molecular formula
- C14H14N4OS
- Molecular weight
- 286.35
Names & synonyms
Thiourea, N-[4-(2-formylhydrazino)phenyl]-N'-phenyl-Thiourea, N-(4-(2-formylhydrazino)phenyl)-N'-phenyl-Thiourea, N-(4-(2-formylhydrazinyl)phenyl)-N'-phenyl-Thiourea, N-[4-(2-formylhydrazinyl)phenyl]-N'-phenyl-RefChem:89797163148-78-7SCHEMBL9174022DTXSID9069718DB-3269431-[4-(2-Formylhydrazino)phenyl]-3-phenylthioureaN-[4-(2-Formylhydrazin-1-yl)phenyl]-N'-phenylthioureaN-[4-(2-FORMYLHYDRAZINO)PHENYL ]-N'-PHENYLTHIOUREA
Show more names
N-[4-(2-Formylhydrazino)phenyl]-N'-phenylthiourea
Database identifiers
- CAS
63148-78-7- PubChem CID
- 2724474
- DTXSID
DTXSID9069718- Nikkaji
- J429.523D
Properties
Computed structural properties
- XLogP
- 2.6
- Topological polar surface area
- 97.3 Ų
- Hydrogen bond donors
- 4
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 4
- Heavy atoms
- 20
- Formal charge
- 0
- Complexity
- 312
Physicochemical properties
- Boiling point
- 437.3 · 437.3±55.0 °C(Predicted)
- Density
- 1.408 · 1.408±0.06 g/cm3(Predicted)
- pka
- 12.41 · 12.41±0.70(Predicted)
- EPA Substance Registry System
- 4 · Thiourea, N-[4-(2-formylhydrazino)phenyl]-N'-phenyl- (63148-78-7)
- TSCA
- TSCA listed
Safety & regulation
Safety information is for reference only and does not replace the supplier’s Safety Data Sheet (SDS), applicable regulations, or professional assessment.
Safety data
- tsca
- TSCA listed
Chemistry & industry
Uses & manufacturing
General Manufacturing InformationThiourea, N-[4-(2-formylhydrazinyl)phenyl]-N'-phenyl-: INACTIVE
Related reactions
3 records
Compound notes
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