4-Anilinopiperidine

HCID 89982CAS 23056-29-3

Substructure search Find similar structures

Basic information

Standard SMILES: c1ccc(NC2CCNCC2)cc1
InChIKey: LKRMTUUCKBQGFO-UHFFFAOYSA-N
Molecular formula: C11H16N2
Average molar mass: 176.26 g/mol
Monoisotopic mass: 176.13134851

Names & identifiers

Preferred name: 4-Anilinopiperidine
IUPAC: N-phenylpiperidin-4-amine
English name: N-phenylpiperidin-4-amine
Molecular formula: C11H16N2
Molecular weight: 176.26

Names & synonyms

N-Phenylpiperidin-4-amine4-anilinopiperidine4-Piperidinamine, N-phenyl-4-(phenylamino)piperidineCQ9ROS690XEINECS 245-402-9NSC-80678DTXSID40177624N-(PIPERIDIN-4-YL)ANILINENSC 80678FENTANYL CITRATE IMPURITY F [EP IMPURITY]FENTANYL CITRATE IMPURITY F (EP IMPURITY)

Show more names

N-phenylpiperidin-4-Fentanyl EP Impurity IDespropionyl norfentanylphenyl(4-piperidyl)amineN-Phenylpiperidin-4-aMin4-Piperidinamine,N-phenyl-Fentanyl Related CoMpound BPhenyl-Piperidine-4-YL-Amine

RefChem:518332DTXCID00100115245-402-9N-phenylpiperidin-4-amine (4-anilinopiperidine;N-phenyl-4-piperidinamine; 4-AP), its amides, its carbamates, its halides, its salts, and any combination thereof, whenever the existence of such is possible23056-29-3N-Phenyl-4-piperidinaminePhenyl-piperidin-4-yl-aminen-phenyl-n-(4-piperidyl)amine

Database identifiers

CAS: 23056-29-3
PubChem CID: 89982
DTXSID: DTXSID40177624
UNII: CQ9ROS690X
EC Number: 245-402-9
Nikkaji: J307.766G

Properties

Computed structural properties

XLogP: 2
Topological polar surface area: 24.1 Å²
Hydrogen bond donors: 2
Hydrogen bond acceptors: 2
Rotatable bonds: 2
Heavy atoms: 13
Formal charge: 0
Complexity: 135

Experimental & physicochemical properties

Drugs · 2 items

DEA NFLIS-Drug Category -> Fentanyl and Fentanyl-related

Pharmaceuticals -> Synthetic Cannabinoids or Psychoactive Compounds

Physicochemical properties

Boiling point: 312 · 312.0±35.0 °C(Predicted)
Density: 1.052 · 1.052±0.06 g/cm3(Predicted)
storage temp.: -20 °C · Store at -20°C
solubility: 30 mg/ml,DMSO: · DMF: 30 mg/ml,DMSO: 30 mg/ml,Ethanol: 30 mg/ml
form: A crystalline solid
pka: 9.83 · 9.83±0.10(Predicted)
FDA UNII: 9 ROS690X · CQ9ROS690X
Symbol(GHS): 7 · GHS07
Signal word: Warning
Hazard statements: 315 · H315-H319
Precautionary statements: 264 · P264-P280-P302+P352-P337+P313-P305+P351+P338-P362+P364-P332+P313
HazardClass: IRRITANT
HS Code: 2933399090 · 2933399090

Safety & regulation

GHS classification

GHS Classification · 4 items

Warning

H302 (100%): Harmful if swallowed [Warning Acute toxicity, oral]

P261, P264, P264+P265, P270, P271, P280, P301+P317, P302+P352, P304+P340, P305+P351+P338, P319, P321, P330, P332+P317, P337+P317, P362+P364, P403+P233, P405, and P501 (click each P-code to see the statement)

The GHS information provided by 1 company from 1 notification to the ECHA C&L Inventory.

Hazard information

Regulatory Information · 1 item

List I Chemical: A chemical specified by regulation that, in addition to legitimate uses, is used in manufacturing a controlled substance in violation of the Act and is important to the manufacture of a controlled substance. (21 eCFR 1310.02)

Hazard Classes and CategoriesAcute Tox. 4 (100%)

Safety data

hs_code: 2933399090
Signal word: Warning
Symbol(GHS): GHS07
hazard_class: IRRITANT
Hazard statements: H315-H319
Precautionary statements: P264-P280-P302+P352-P337+P313-P305+P351+P338-P362+P364-P332+P313

Chemistry & industry

Uses & manufacturing

DEA Listed Chemicals · 2 items

N-phenylpiperidin-4-amine (4-anilinopiperidine;N-phenyl-4-piperidinamine; 4-AP), its amides, its carbamates, its halides, its salts, and any combination thereof, whenever the existence of such is possible

A chemical specified by regulation that, in addition to legitimate uses, is used in manufacturing a controlled substance in violation of the Act and is important to the manufacture of a controlled substance. (21 eCFR 1310.02)