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3-(2-Fluoroethyl)-1-methyl-1-nitrosourea

HCID 260613
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Basic informationNames & identifiersPropertiesRelated reactionsCompound notes
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Basic information

CAS
13908-88-8
Standard SMILES
CN(N=O)C(=O)NCCF
InChIKey
RGWOPTCWCOAICV-UHFFFAOYSA-N
Molecular formula
C4H8FN3O2
Average molar mass
149.12 g/mol
Monoisotopic mass
149.06005467

Names & identifiers

Preferred name
3-(2-Fluoroethyl)-1-methyl-1-nitrosourea
IUPAC
3-(2-fluoroethyl)-1-methyl-1-nitrosourea

Names & synonyms

13908-88-83-(2-fluoroethyl)-1-methyl-1-nitrosoureaNSC92151DTXSID60293774NSC-92151AKOS006355912DS-013772N'-(2-Fluoroethyl)-N-methyl-N-nitrosourea3-(2-Fluoroethyl)-1-methyl-1-nitroso-urea

Database identifiers

CAS
13908-88-8
PubChem CID
260613
DTXSID
DTXSID60293774

Properties

Computed structural properties

XLogP
0.2
Topological polar surface area
61.8 Ų
Hydrogen bond donors
1
Hydrogen bond acceptors
4
Rotatable bonds
2
Heavy atoms
10
Formal charge
0
Complexity
130

Related reactions

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Compound notes

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