Basic information
- CAS
119034-13-8- Standard SMILES
O=C(N/N=C/c1ccco1)Nc1ccccc1- InChIKey
YRIUZBFPCBYSBJ-UKTHLTGXSA-N- Molecular formula
- C12H11N3O2
- Average molar mass
- 229.23 g/mol
- Monoisotopic mass
- 229.0851266
Names & identifiers
- Preferred name
- 2-Furaldehyde N-phenylsemicarbazone
- IUPAC
- 1-[(E)-furan-2-ylmethylideneamino]-3-phenylurea
- English name
- 2-furaldehyde N-phenylsemicarbazone
- Molecular formula
- C12H11N3O2
- Molecular weight
- 229.24
Names & synonyms
2-furaldehyde N-phenylsemicarbazoneRefChem:472728659-042-9119034-13-8Hydrazinecarboxamide,2-(2-furanylmethylene)-N-phenyl-2-Furaldehyde, 4-phenylsemicarbazoneSemicarbazide, 1-furfurylidene-4-phenyl-MLS000569571CHEMBL3198318Hydrazinecarboxamide, 2-(2-furanylmethylene)-N-phenyl-STK089336AKOS000489270
Show more names
NCGC00245541-01SMR000184344ST45036020SR-01000195335SR-01000195335-1[((1E)-2-(2-furyl)-1-azavinyl)amino]-N-benzamide(2E)-2-(furan-2-ylmethylidene)-N-phenylhydrazinecarboxamide
Database identifiers
- CAS
119034-13-8- PubChem CID
- 6894875
- ChEMBL
CHEMBL3198318- EC Number
- 659-042-9
Properties
Computed structural properties
- XLogP
- 2
- Topological polar surface area
- 66.6 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 3
- Heavy atoms
- 17
- Formal charge
- 0
- Complexity
- 275
Experimental & physicochemical properties
LogP2.52
Physicochemical properties
- Melting point
- 181 °C · 181 °C
- Density
- 1.22 · 1.22±0.1 g/cm3(Predicted)
- pka
- 9.86 · 9.86±0.46(Predicted)
- Symbol(GHS)
- 7 · GHS07
- Signal word
- Warning
- Hazard statements
- 302 · H302
- Precautionary statements
- 264 · P264-P270-P301+P312-P330-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
H302 (100%): Harmful if swallowed [Warning Acute toxicity, oral]
P264, P270, P301+P317, P330, and P501 (click each P-code to see the statement)
Aggregated GHS information provided per 39 reports by companies from 1 notifications to the ECHA C&L Inventory.
Hazard information
Hazard Classes and CategoriesAcute Tox. 4 (100%)
Safety data
- Signal word
- Warning
- Symbol(GHS)
- GHS07
- Hazard statements
- H302
- Precautionary statements
- P264-P270-P301+P312-P330-P501
Chemistry & industry
Suppliers1 total
Alinda Chemical Ltd.+7 (495) 672-17-08 · [email protected]
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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