ChemicalBook--->CAS DataBase List--->529-33-9

529-33-9

529-33-9 Structure

529-33-9 Structure
IdentificationMore
[Name]

1,2,3,4-Tetrahydro-1-naphthol
[CAS]

529-33-9
[Synonyms]

1,2,3,4-TETRAHYDRO-1-NAPHTHOL
1,2,3,4-TETRAHYDRONAPHTHALEN-1-OL
1-HYDROXYTETRALIN
1-TETRALOL
AC-ALPHA-TETRALOL
(+/-)-ALPHA-TETRALOL
ALPHA-TETRALOL
A-TETRALOL
1,2,3,4-tetrahydro-1-naphthaleno
1,2,3,4-Tetrahydro-1-naphthalenol
1,2,3,4-tetrahydro-1-naphtho
1,2,3,4-tetrahydro-1-napthol
1,2,3,4-Tetrahydro-alpha-naphthol
1-Naphthol, 1,2,3,4-tetrahydro-
Tetrahydro-1-naphthol
Tetralin-1-ol
1,2,3,4-Tetrahydro-a-naphthol
(1R)-1,2,3,4-Tetrahydro-1-naphthol
(1R)-Tetralin-1-ol
(R)-1-Hydroxy-1,2,3,4-tetrahydronaphthalene
[EINECS(EC#)]

208-459-0
[Molecular Formula]

C10H12O
[MDL Number]

MFCD00001739
[Molecular Weight]

148.2
[MOL File]

529-33-9.mol
Chemical PropertiesBack Directory
[Appearance]

clear colourless to slightly brown viscous liquid
[Melting point ]

28-32 °C
[Boiling point ]

102-104 °C2 mm Hg(lit.)
[density ]

1.09 g/mL at 25 °C(lit.)
[refractive index ]

n20/D 1.564(lit.)
[Fp ]

>230 °F
[storage temp. ]

2-8°C
[solubility ]

5.09g/l
[form ]

powder to lump to clear liquid
[pka]

14.33±0.20(Predicted)
[color ]

White or Colorless to Light yellow
[Specific Gravity]

1.090
[BRN ]

2046227
[Cosmetics Ingredients Functions]

PERFUMING
[InChI]

1S/C10H12O/c11-10-7-3-5-8-4-1-2-6-9(8)10/h1-2,4,6,10-11H,3,5,7H2
[InChIKey]

JAAJQSRLGAYGKZ-UHFFFAOYSA-N
[SMILES]

OC1CCCc2ccccc12
[LogP]

1.980
[CAS DataBase Reference]

529-33-9(CAS DataBase Reference)
[NIST Chemistry Reference]

1-Naphthalenol, 1,2,3,4-tetrahydro-(529-33-9)
[EPA Substance Registry System]

529-33-9(EPA Substance)
Safety DataBack Directory
[Hazard Codes ]

Xn
[Risk Statements ]

R22:Harmful if swallowed.
R36/37/38:Irritating to eyes, respiratory system and skin .
[Safety Statements ]

S22:Do not breathe dust .
S24/25:Avoid contact with skin and eyes .
S37/39:Wear suitable gloves and eye/face protection .
S26:In case of contact with eyes, rinse immediately with plenty of water and seek medical advice .
[WGK Germany ]

3
[RTECS ]

QL5075000
[TSCA ]

TSCA listed
[REACH Registrations]

Active
[HS Code ]

29062900
[Storage Class]

11 - Combustible Solids
[Hazard Classifications]

Acute Tox. 4 Oral
Raw materials And Preparation ProductsBack Directory
[Raw materials]

1,2,3,4-Tetrahydronaphthalene-->[1,1'-Binaphthalene]-1,1'(2H,2'H)-diol, 3,3',4,4'-tetrahydro--->1,2,3,4-tetrahydro-1-naphthyl hydroperoxide-->1,2,3,4-Tetrahydro-2-naphthol-->1,2-Dihydronaphthalene
[Preparation Products]

Brodifacoum-->Flocoumafen-->Coumatetralyl-->5,6,7,8-Tetrahydronaphthalene-1-carboxylic acid-->8-Bromo-3,4-dihydro-2H-naphthalen-1-one-->(R)-(-)-1,2,3,4-Tetrahydro-1-naphthol-->5,6,7,8-Tetrahydro-1-naphthol-->2,3,4,5-Tetrahydro-1H-benzo[b]azepine-->1,2,3,4-Tetrahydro-1-naphthylamine-->2,3-Dihydro-1,4-naphthoquinone-->(S)-(+)-1,2,3,4-Tetrahydro-1-naphthol
Material Safety Data Sheet(MSDS)Back Directory
[msds information]

alpha-Tetralol(529-33-9).msds
Hazard InformationBack Directory
[Chemical Properties]

clear colourless to slightly brown viscous liquid
[Uses]

1,2,3,4-Tetrahydro-1-naphthol was used as chiral probe to examine the role of three aromatic residues in enzyme-substrate interactions at the sulfuryl acceptor binding site of aryl sulfotransferase IV enzyme.
[Synthesis Reference(s)]

The Journal of Organic Chemistry, 61, p. 1493, 1996 DOI: 10.1021/jo951219c
[General Description]

(R)-(-)-enantiomer of 1,2,3,4-Tetrahydro-1-naphthol is a substrate for aryl sulfotransferase (AST) IV enzyme and (S)-(+)-1,2,3,4-tetrahydro-1-naphthol is a competitive inhibitor of AST IV-catalyzed sulfation of 1-naphthalenemethanol. It is the major urinary metabolite of tetralin.
Spectrum DetailBack Directory
[Spectrum Detail]

1,2,3,4-Tetrahydro-1-naphthol(529-33-9)MS
1,2,3,4-Tetrahydro-1-naphthol(529-33-9)1HNMR
1,2,3,4-Tetrahydro-1-naphthol(529-33-9)13CNMR
1,2,3,4-Tetrahydro-1-naphthol(529-33-9)IR1
1,2,3,4-Tetrahydro-1-naphthol(529-33-9)Raman
Well-known Reagent Company Product InformationBack Directory
[Acros Organics]

1,2,3,4-Tetrahydro-1-naphthol, 97%(529-33-9)
[Sigma Aldrich]

529-33-9(sigmaaldrich)
[TCI AMERICA]

1,2,3,4-Tetrahydro-1-naphthol,>95.0%(GC)(529-33-9)
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