CAS 81310-55-6 1-(2-Piperidinylmethyl)piperidine (HCID 254290)

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Basic information

CAS: 81310-55-6
Standard SMILES: C1CCN(CC2CCCCN2)CC1
InChIKey: QYKGBJGIKHJGFR-UHFFFAOYSA-N
Molecular formula: C11H22N2
Average molar mass: 182.31 g/mol
Monoisotopic mass: 182.1782987

Names & identifiers

Preferred name: 1-(2-Piperidinylmethyl)piperidine
IUPAC: 1-(piperidin-2-ylmethyl)piperidine
English name: 1-Piperidin-2-ylmethyl-piperidine
Molecular formula: C11H22N2
Molecular weight: 182.31

Names & synonyms

81310-55-61-(2-piperidinylmethyl)piperidineRefChem:10540491-(Piperidin-2-ylmethyl)piperidine1-Piperidin-2-ylmethyl-piperidinePiperidine, 1-(2-piperidinylmethyl)-MLS0026940661-(2-piperidinylmethyl)-piperidineMFCD00085502NSC78464(2-piperidylmethyl)piperidineSCHEMBL1232420

Show more names

1,2'-Methylenedipiperidine2-(PIPERIDINOMETHYL)-PIPERIDINE1-(piperidin-2-ylmethyl)piperidine(SALTDATA: FREE)

SCHEMBL24390431-(2-piperidylmethyl)piperidineCHEMBL1698627DTXSID10291821HMS3088K11ALBB-0209232-(piperidin-1-ylmethyl)-piperidine2-[(1-piperidinyl)methyl]piperidine

Database identifiers

CAS: 81310-55-6
PubChem CID: 254290
DTXSID: DTXSID10291821
ChEMBL: CHEMBL1698627
EC Number: 636-018-6
Nikkaji: J285.738C

Properties

Computed structural properties

XLogP: 1.6
Topological polar surface area: 15.3 Å²
Hydrogen bond donors: 1
Hydrogen bond acceptors: 2
Rotatable bonds: 2
Heavy atoms: 13
Formal charge: 0
Complexity: 141

Physicochemical properties

storage temp.: 2 · 2-8°C
Symbol(GHS): 5 · GHS05,GHS07
Signal word: Danger
Hazard statements: 302 · H302-H315-H318-H335
Precautionary statements: 310 · P310-P261-P280
HS Code: 2933399990 · 2933399990

Safety & regulation

GHS classification

GHS Classification · 4 items

Danger

H302 (97.6%): Harmful if swallowed [Warning Acute toxicity, oral]

P261, P264, P264+P265, P270, P271, P280, P301+P317, P302+P352, P304+P340, P305+P354+P338, P317, P319, P321, P330, P332+P317, P362+P364, P403+P233, P405, and P501 (click each P-code to see the statement)

Aggregated GHS information provided per 41 reports by companies from 4 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.