Furfuryl N-(4-bromophenyl)carbamate
Basic information
- CAS
25203-41-2- Standard SMILES
O=C(Nc1ccc(Br)cc1)OCc1ccco1- InChIKey
HSZQFDJPQVGVEE-UHFFFAOYSA-N- Molecular formula
- C12H10BrNO3
- Average molar mass
- 296.12 g/mol
- Monoisotopic mass
- 294.98441
Names & identifiers
- Preferred name
- Furfuryl N-(4-bromophenyl)carbamate
- IUPAC
- furan-2-ylmethyl N-(4-bromophenyl)carbamate
- English name
- Furfuryl N-(4-bromophenyl)carbamate
- Molecular formula
- C12H10BrNO3
- Molecular weight
- 296.12
Names & synonyms
25203-41-2FURFURYL N-(4-BROMOPHENYL)CARBAMATERefChem:607807665-779-7Furan-2-ylmethyl (4-bromophenyl)carbamateSCHEMBL12826767AKOS024336001Carbamic acid, N-(4-bromophenyl)-, 2-furanylmethyl ester
Database identifiers
- CAS
25203-41-2- PubChem CID
- 4491847
- EC Number
- 665-779-7
Properties
Computed structural properties
- XLogP
- 2.8
- Topological polar surface area
- 51.5 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 4
- Heavy atoms
- 17
- Formal charge
- 0
- Complexity
- 254
Physicochemical properties
- Boiling point
- 343.8 · 343.8±32.0 °C(Predicted)
- Density
- 1.57 · 1.570±0.06 g/cm3(Predicted)
- pka
- 12.6 · 12.60±0.70(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 38 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
Suppliers
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Related reactions
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Compound notes
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