8-Azabicyclo[3.2.1]octane hydrochloride

HCID 522272

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Basic information

CAS: 6760-99-2
Standard SMILES: C1CC2CCC(C1)N2.Cl
InChIKey: VAINBTSWOOHLOV-UHFFFAOYSA-N
Molecular formula: C7H14ClN
Average molar mass: 147.64 g/mol
Monoisotopic mass: 147.0814771

Names & identifiers

Preferred name: 8-Azabicyclo[3.2.1]octane hydrochloride
IUPAC: 8-azabicyclo[3.2.1]octane;hydrochloride
English name: 8-Azabicyclo[3.2.1]octane hydrochloride
Molecular formula: C7H14ClN
Molecular weight: 147.64576

Names & synonyms

8-azabicyclo[3.2.1]octane hydrochloride6760-99-2DTXSID303349068-azabicyclo(3.2.1)octane hydrochlorideRefChem:311748DTXCID40285995816-943-38-Azabicyclo[3.2.1]octane, hydrochloride8-aza-bicyclo[3.2.1]octane hydrochlorideMFCD199825618-Azabicyclo[3.2.1]octane HCl8-azabicyclo[3.2.1]octane;hydrochloride

Show more names

8-Azabicyclo[3.2.1]octane hydrochloride 95+%8-azabiscyclo[3.2.1]octylalkanehydrochloride8-Azabicyclo[3.2.1]octane, hydrochloride (1:1)

SCHEMBL1955818VAINBTSWOOHLOV-UHFFFAOYSA-NAKOS024463995DS-7448SB100898-azabicyclo[3.2.1]octanehydrochlorideSY097135DB-264167

Database identifiers

CAS: 6760-99-2
PubChem CID: 522272
DTXSID: DTXSID30334906
EC Number: 816-943-3

Properties

Computed structural properties

Topological polar surface area: 12 Å²
Hydrogen bond donors: 2
Hydrogen bond acceptors: 1
Rotatable bonds: 0
Heavy atoms: 9
Formal charge: 0
Complexity: 80

Physicochemical properties

Melting point: 307 · 307-308 °C
storage temp.: 2 · under inert gas (nitrogen or Argon) at 2-8°C
Appearance: White to off-white Solid
InChI: InChI=1S/C7H13N.ClH/c1-2-6-4-5-7(3-1)8-6;/h6-8H,1-5H2;1H
InChIKey: VAINBTSWOOHLOV-UHFFFAOYSA-N
SMILES: C12NC(CC1)CCC2.[H]Cl
Symbol(GHS): 7 · GHS07
Signal word: Warning
Hazard statements: 302 · H302-H315-H319-H335
Precautionary statements: 261 · P261-P305+P351+P338
HS Code: 2904200090 · 2904200090

Safety & regulation

GHS classification

GHS Classification · 5 items

Warning

H315 (100%): Causes skin irritation [Warning Skin corrosion/irritation]；H319 (100%): Causes serious eye irritation [Warning Serious eye damage/eye irritation]；H335 (100%): May cause respiratory irritation [Warning Specific target organ toxicity, single exposure; Respiratory tract irritation]

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

Aggregated GHS information provided per 2 reports by companies from 2 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.；Information may vary between notifications depending on impurities, additives, and other factors. The percentage value in parenthesis indicates the notified classification ratio from companies that provide hazard codes. Only hazard codes with percentage values above 10% are shown. For more detailed information, please visit ECHA C&L website.