CAS 92050-16-3 5,5,8,8-Tetramethyl-5,6,7,8-tetrahydronaphthalen-2-amine (HCID 11469760)

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Basic information

CAS: 92050-16-3
Standard SMILES: CC1(C)CCC(C)(C)c2cc(N)ccc21
InChIKey: AMDKYPNODLTUMY-UHFFFAOYSA-N
Molecular formula: C14H21N
Average molar mass: 203.32 g/mol
Monoisotopic mass: 203.16739967

Names & identifiers

Preferred name: 5,5,8,8-Tetramethyl-5,6,7,8-tetrahydronaphthalen-2-amine
IUPAC: 5,5,8,8-tetramethyl-6,7-dihydronaphthalen-2-amine
English name: 5,5,8,8-Tetramethyl-5,6,7,8-tetrahydronaphthalen-2-ylamine
Molecular formula: C14H21N
Molecular weight: 203.32

Names & synonyms

92050-16-35,5,8,8-tetramethyl-5,6,7,8-tetrahydronaphthalen-2-amineDTXSID50466874RefChem:298260DTXCID404176935,5,8,8-Tetramethyl-5,6,7,8-tetrahydronaphthalen-2-ylamine5,5,8,8-tetramethyl-6,7-dihydronaphthalen-2-amine5,6,7,8-Tetrahydro-5,5,8,8-tetramethyl-2-naphthylamineMFCD128282022-Naphthalenamine, 5,6,7,8-tetrahydro-5,5,8,8-tetramethyl-Tamibarotene Impurity 12-amino-5,5,8,8-tetramethyl-5,6,7,8-tetrahydronaphthalene

Show more names

5,6,7,8-tetrahydro-5,5,8,8-tetramethyl-2-napthylamine2-Naphthalenamine,5,6,7,8-tetrahydro-5,5,8,8-tetramethyl-5,5,8,8-Tetramethyl-5,6,7,8-tetrahydronaphthalen-2-ylamine，98% min5,5,8,8-Tetramethyl-5,6,7,8-tetrahydronaphthalen-2-ylamine ISO 9001：2015 REACH

5,6,7,8-Tetrahydro-5,5,8,8-tetramethyl-2-naphthalenamine1,1,4,4-tetramethyltetralin-6-amineSCHEMBL447737SCHEMBL29707990AMDKYPNODLTUMY-UHFFFAOYSA-N5,5,8,8-tetramethyl-5,6,7,8-tetrahydro-naphthalen-2-ylamineXH1341AKOS015915436

Properties

Computed structural properties

XLogP: 4.4
Topological polar surface area: 26 Å²
Hydrogen bond donors: 1
Hydrogen bond acceptors: 1
Rotatable bonds: 0
Heavy atoms: 15
Formal charge: 0
Complexity: 242

Physicochemical properties

Melting point: 63 · 63-65℃
Boiling point: 310.2 · 310.2±31.0 °C(Predicted)
Density: 0.944 · 0.944
storage temp.: Keep in dark place,Sealed in dry,Room Temperature
pka: 5.16 · 5.16±0.60(Predicted)
Appearance: Off-white to light brown Solid
InChI: InChI=1S/C14H21N/c1-13(2)7-8-14(3,4)12-9-10(15)5-6-11(12)13/h5-6,9H,7-8,15H2,1-4H3
InChIKey: AMDKYPNODLTUMY-UHFFFAOYSA-N
SMILES: C1=C2C(C(C)(C)CCC2(C)C)=CC=C1N
Symbol(GHS): 7 · GHS07
Signal word: Warning
Hazard statements: 302 · H302-H315-H319-H335
Precautionary statements: 261 · P261-P305+P351+P338