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1-(Oxan-4-yl)propan-2-amine hydrochloride

HCID 68720808
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Basic information

CAS
857177-23-2
Standard SMILES
CC(N)CC1CCOCC1.Cl
InChIKey
WRDHCSRNQXUDMV-UHFFFAOYSA-N
Molecular formula
C8H18ClNO
Average molar mass
179.69 g/mol
Monoisotopic mass
179.1076919

Names & identifiers

Preferred name
1-(Oxan-4-yl)propan-2-amine hydrochloride
IUPAC
1-(oxan-4-yl)propan-2-amine;hydrochloride

Names & synonyms

1-(oxan-4-yl)propan-2-amine hydrochloride857177-23-21-(Tetrahydro-2H-pyran-4-yl)propan-2-amine hydrochlorideMFCD216026341-(oxan-4-yl)propan-2-amine;hydrochloride1-(Tetrahydro-2H-pyran-4-yl)-2-propanamine HydrochlorideSCHEMBL3633106HJB17723AKOS026742854SY193598DB-190670CS-0265310
Show more names
EN300-97651H594831-(Tetrahydro-2H-pyran-4-yl)-2-propanamine HCl1-(Tetrahydro-2H-pyran-4-yl)propan-2-aminehydrochlorideZ1318147465

Database identifiers

CAS
857177-23-2
PubChem CID
68720808
EC Number
173-014-9

Properties

Computed structural properties

Topological polar surface area
35.3 Ų
Hydrogen bond donors
2
Hydrogen bond acceptors
2
Rotatable bonds
2
Heavy atoms
11
Formal charge
0
Complexity
89.3

Safety & regulation

Safety information is for reference only and does not replace the supplier’s Safety Data Sheet (SDS), applicable regulations, or professional assessment.

GHS classification

GHS Classification · 4 items

Warning

H315 (100%): Causes skin irritation [Warning Skin corrosion/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)

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

Hazard information

Hazard Classes and CategoriesSkin Irrit. 2 (100%)

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Compound notes

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