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1-Piperidinecarboxylic acid, isopropyl ester

HCID 239243
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Basic informationNames & identifiersPropertiesRelated reactionsCompound notes
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Basic information

CAS
6301-08-2
Standard SMILES
CC(C)OC(=O)N1CCCCC1
InChIKey
NVMHDJQDTCMXLH-UHFFFAOYSA-N
Molecular formula
C9H17NO2
Average molar mass
171.24 g/mol
Monoisotopic mass
171.12592879

Names & identifiers

Preferred name
1-Piperidinecarboxylic acid, isopropyl ester
IUPAC
propan-2-yl piperidine-1-carboxylate

Names & synonyms

1-Piperidinecarboxylic acid, isopropyl esterN-(Isopropoxycarbonyl)piperidine6301-08-289G5X4BJFCNSC-44153propan-2-yl piperidine-1-carboxylate1-(Isopropoxycarbonyl)piperidineN-(1-Methylethoxycarbonyl)piperidineUNII-89G5X4BJFC1-Piperidinecarboxylic acid, 1-methylethyl esterisopropyl 4-(2-(tert-butoxycarbonyl)hydrazinyl)piperidine-1-carboxylateNSC44153
Show more names
SCHEMBL390019SCHEMBL1713628SCHEMBL9987835DTXSID50286195isopropyl piperidine-1-carboxylateNVMHDJQDTCMXLH-UHFFFAOYSA-NDB-188872piperidine-1-carboxylic acid isopropyl ester

Database identifiers

CAS
6301-08-2
PubChem CID
239243
DTXSID
DTXSID50286195
UNII
89G5X4BJFC
Nikkaji
J2.670.173B

Properties

Computed structural properties

XLogP
1.8
Topological polar surface area
29.5 Ų
Hydrogen bond donors
0
Hydrogen bond acceptors
2
Rotatable bonds
2
Heavy atoms
12
Formal charge
0
Complexity
151

Related reactions

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Compound notes

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