Basic information
- CAS
13908-91-3- Standard SMILES
O=NN(CCF)C(=O)NCCF- InChIKey
GWRLHZIGYXCDKL-UHFFFAOYSA-N- Molecular formula
- C5H9F2N3O2
- Average molar mass
- 181.14 g/mol
- Monoisotopic mass
- 181.06628286
Overview
RN given refers to unlabled cpd
Names & identifiers
- Preferred name
- Bis-(fluoroethyl)nitrosourea
- IUPAC
- 1,3-bis(2-fluoroethyl)-1-nitrosourea
- English name
- Bis(fluoroethyl)nitrosourea
- Molecular weight
- 0
Names & synonyms
Bis(fluoroethyl)nitrosourea1,3-Bis(2-fluoroethyl)-1-nitrosourea13908-91-3BFNUBis-(fluoroethyl)nitrosoureaUrea, 1,3-bis(2-fluoroethyl)-1-nitroso-Urea, N,N'-bis(2-fluoroethyl)-N-nitroso-NSC-91728F37G38Q4X7DTXSID601608961,1-d2-cpd of bis-(fluoroethyl)nitrosoureaRefChem:120301
Show more names
DTXCID0083387BFNU-1,1,1',1'-d4NSC 91,728BRN 1956526AI3-52785Urea, N,N'-bis(2-fluoroethyl)-N'-nitroso-1,3-BIS(2-FLUOROETHYL)-3-NITROSOUREACHEMBL12563
Database identifiers
- CAS
13908-91-3- PubChem CID
- 96886
- DTXSID
DTXSID60160896- ChEMBL
CHEMBL12563- UNII
- F37G38Q4X7
- Nikkaji
- J54.237G
Properties
Computed structural properties
- XLogP
- 0.7
- Topological polar surface area
- 61.8 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 5
- Rotatable bonds
- 4
- Heavy atoms
- 12
- Formal charge
- 0
- Complexity
- 156
Experimental & physicochemical properties
SpringerMaterials Properties15N nuclear magnetic resonance spectrum
Physicochemical properties
- FDA UNII
- 37 G38Q4X7 · F37G38Q4X7
- Toxicity
- 10 intraperitoneal · LD10 intraperitoneal in mouse: 7mg/kg
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
- Toxicity
- LD10 intraperitoneal in mouse: 7mg/kg
Chemistry & industry
Suppliers1 total
HONEST JOY HOLDINGS LIMITED[email protected]
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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