5-Methoxy-1,2,3,4-tetrahydronaphthalen-1-amine

HCID 38899CAS 52372-97-1

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Basic information

Standard SMILES: COc1cccc2c1CCCC2N
InChIKey: WGLJGXBRZQHFBR-UHFFFAOYSA-N
Molecular formula: C11H15NO
Average molar mass: 177.24 g/mol
Monoisotopic mass: 177.1153641

Names & identifiers

Preferred name: 5-Methoxy-1,2,3,4-tetrahydronaphthalen-1-amine
IUPAC: 5-methoxy-1,2,3,4-tetrahydronaphthalen-1-amine
English name: 5-Methoxy-1,2,3,4-tetrahydronaphthalen-1-aMine
Molecular formula: C11H15NO
Molecular weight: 177.24

Names & synonyms

5-methoxy-1,2,3,4-tetrahydronaphthalen-1-amine52372-97-1MFCD073740141,2,3,4-Tetrahydro-5-methoxy-1-naphthalenamine1-naphthalenamine, 1,2,3,4-tetrahydro-5-methoxy-5-Methoxytetralin-1-amineSCHEMBL265136CHEMBL151754DTXSID80966771WGLJGXBRZQHFBR-UHFFFAOYSA-NAKOS014315644AB29118

Show more names

5-Methoxy-1-tetralinamine(5-Methoxytetralin-1-yl)amine

AB29121AB38532DA-30397CS-0303256EN300-718031N110115-methoxy-1,2,3,4-tetrahydronaphtha-len-1-amine

Database identifiers

CAS: 52372-97-1
PubChem CID: 38899
DTXSID: DTXSID80966771
ChEMBL: CHEMBL151754
Nikkaji: J1.120.546A

Properties

Computed structural properties

XLogP: 1.5
Topological polar surface area: 35.3 Å²
Hydrogen bond donors: 1
Hydrogen bond acceptors: 2
Rotatable bonds: 1
Heavy atoms: 13
Formal charge: 0
Complexity: 171

Physicochemical properties

Melting point: 22 · 22-25℃
storage temp.: 2 · 2-8°C
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

Safety & regulation

Safety data

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