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Methyl N-(2,3,4,5,6-pentafluorophenyl)carbamate

HCID 5215136
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Basic information

CAS
6357-28-4
Standard SMILES
COC(=O)Nc1c(F)c(F)c(F)c(F)c1F
InChIKey
KCYFPJHVBOBFOL-UHFFFAOYSA-N
Molecular formula
C8H4F5NO2
Average molar mass
241.11 g/mol
Monoisotopic mass
241.01621918

Names & identifiers

Preferred name
Methyl N-(2,3,4,5,6-pentafluorophenyl)carbamate
IUPAC
methyl N-(2,3,4,5,6-pentafluorophenyl)carbamate

Names & synonyms

6357-28-4Methyl N-(2,3,4,5,6-pentafluorophenyl)carbamateDTXSID50410554Methyl (pentafluorophenyl)carbamateAKOS003867540

Database identifiers

CAS
6357-28-4
PubChem CID
5215136
DTXSID
DTXSID50410554

Properties

Computed structural properties

XLogP
2.1
Topological polar surface area
38.3 Ų
Hydrogen bond donors
1
Hydrogen bond acceptors
7
Rotatable bonds
2
Heavy atoms
16
Formal charge
0
Complexity
251

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Compound notes

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