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Tert-butyl 8-(2,2-difluoroethyl)-10-propanoyl-11-oxa-3,8-diazaspiro[5.5]undecane-3-carboxylate

HCID 86672467
NotesReactions
Basic informationNames & identifiersPropertiesRelated reactionsCompound notes
Substructure searchFind similar structures

Basic information

Standard SMILES
CCC(=O)C1CN(CC(F)F)CC2(CCN(C(=O)OC(C)(C)C)CC2)O1
InChIKey
LOGXOEIKTGQLFW-UHFFFAOYSA-N
Molecular formula
C18H30F2N2O4
Average molar mass
376.4 g/mol

Names & identifiers

Preferred name
Tert-butyl 8-(2,2-difluoroethyl)-10-propanoyl-11-oxa-3,8-diazaspiro[5.5]undecane-3-carboxylate
IUPAC
tert-butyl 4-(2,2-difluoroethyl)-2-propanoyl-1-oxa-4,9-diazaspiro[5.5]undecane-9-carboxylate

Names & synonyms

tert-butyl 8-(2,2-difluoroethyl)-10-propanoyl-11-oxa-3,8-diazaspiro[5.5]undecane-3-carboxylateSCHEMBL13277874

Database identifiers

PubChem CID
86672467

Properties

Computed structural properties

XLogP
2.3
Topological polar surface area
59.1 Ų
Hydrogen bond donors
0
Hydrogen bond acceptors
7
Rotatable bonds
6
Heavy atoms
26
Formal charge
0
Complexity
514

Related reactions

3 records
New reaction record
HRID 72883 reaction equation
HRID 72883As productuspto-grants-2014_09
HRID 712967 reaction equation
HRID 712967As productuspto-grants-2015_11
HRID 712968 reaction equation
HRID 712968As reactantuspto-grants-2015_11

Compound notes

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On this pageBasic informationNames & identifiersPropertiesRelated reactionsCompound notes