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3-Chloropiperidine

HCID 424919
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Basic information

CAS
50564-59-5
Standard SMILES
ClC1CCCNC1
InChIKey
YQUBWBSLSNIUBN-UHFFFAOYSA-N
Molecular formula
C5H10ClN
Average molar mass
119.59 g/mol
Monoisotopic mass
119.050177

Names & identifiers

Preferred name
3-Chloropiperidine
IUPAC
3-chloropiperidine
English name
3-CHLORO-PIPERIDINE
Molecular formula
C5H10ClN
Molecular weight
119.59

Names & synonyms

3-chloropiperidine50564-59-5DTXSID20329902RefChem:278628DTXCID102809973-CHLORO-PIPERIDINEPiperidine, 3-chloro-SCHEMBL2040204SCHEMBL2040692SCHEMBL2042153SCHEMBL4811100AKOS006352427
Show more names
SB37408DB-071222CS-0453093

Database identifiers

CAS
50564-59-5
PubChem CID
424919
DTXSID
DTXSID20329902

Properties

Computed structural propertiesFilling in

XLogP
0.9
Topological polar surface area
12 Ų
Hydrogen bond donors
1
Hydrogen bond acceptors
1
Rotatable bonds
0
Heavy atoms
7
Formal charge
0
Complexity
56

Physicochemical properties

Boiling point
174 ℃ · 174℃
Density
1.06 · 1.06
Flash point
59 ℃ · 59℃

Chemistry & industry

Upstream & downstream products

Upstream raw materials

3-Chloropyridine

Related reactions

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Compound notes

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