5,6,7,8-Tetrahydro-1-naphthol

HCID 68258CAS 529-35-1
Substructure searchFind similar structures

Basic information

Standard SMILES
Oc1cccc2c1CCCC2
InChIKey
SCWNNOCLLOHZIG-UHFFFAOYSA-N
Molecular formula
C10H12O
Average molar mass
148.2 g/mol
Monoisotopic mass
148.088815

Overview

5,6,7,8-tetrahydro-1-naphthol is 1-naphthol hydrogenated at C-5, -6, -7 and -8.

Names & identifiers

Preferred name
5,6,7,8-Tetrahydro-1-naphthol
IUPAC
5,6,7,8-tetrahydronaphthalen-1-ol
English name
5,6,7,8-TETRAHYDRO-1-NAPHTHOL
Molecular formula
C10H12O
Molecular weight
148.2

Names & synonyms

5,6,7,8-Tetrahydro-1-naphthol5,6,7,8-tetrahydronaphthalen-1-ol5-Hydroxytetralintetralin-5-ol1-Naphthalenol, 5,6,7,8-tetrahydro-5,6,7,8-Tetrahydro-1-naphthalenol5,6,7,8-tetrahydronaphtholUNII-1R7B5I98HV1R7B5I98HV1,2,3,4-Tetrahydro-5-hydroxynaphthalene1-hydroxy-5,6,7,8-tetrahydronaphthalene1,2,3,4-tetrahydro-5-naphthol
Show more names
Tetrahydro-alpha-naphthol5,6,7,8-TETRAHYDRO-1-NAPTHOL
EINECS 208-461-1NSC 28822NSC-28822DTXSID8074570CHEBI:459005,6,7,8-TetrahydronaphthalenolNaphthalenol, 5,6,7,8-tetrahydro-5,6,7,8-TETRAHYDRO-1-HYDROXYNAPHTHALENE

Database identifiers

CAS
529-35-1
PubChem CID
68258
DTXSID
DTXSID8074570
ChEMBL
CHEMBL449132
ChEBI
CHEBI:45900
UNII
1R7B5I98HV
EC Number
208-461-1
Nikkaji
J6.685K

Properties

Computed structural properties

XLogP
2.9
Topological polar surface area
20.2 Ų
Hydrogen bond donors
1
Hydrogen bond acceptors
1
Rotatable bonds
0
Heavy atoms
11

Experimental & physicochemical properties

SpringerMaterials PropertiesSurface tension

Physicochemical properties

Melting point
69 · 69-71 °C(lit.)
Boiling point
264 · 264-265 °C705 mm Hg(lit.)
Density
1.0556 · 1.0556
refractive index
1.5 · 1.5000 (estimate)
Flash point
264 · 264-265°C/705mm
storage temp.
Inert atmosphere,Room Temperature

Safety & regulation

GHS classification

GHS Classification · 4 items

Danger

H302 (66.7%): Harmful if swallowed [Warning Acute toxicity, oral]

P261, P264, P264+P265, P270, P271, P280, P301+P317, P302+P352, P304+P340, P305+P351+P338, P305+P354+P338, P317, P319, P321, P330, P332+P317, P337+P317, P362+P364, P403+P233, P405, and P501 (click each P-code to see the statement)

Aggregated GHS information provided per 135 reports by companies from 6 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.

Hazard information

Regulatory Information · 2 items

Chemical: 1-Naphthalenol, 5,6,7,8-tetrahydro-

PMN - indicates a commenced PMN (Pre-Manufacture Notices) substance.

Hazard Classes and CategoriesAcute Tox. 4 (66.7%)

Safety data

PPE
dust mask type N95 (US), Eyeshields, Gloves
wgk
3
tsca
TSCA listed
hs_code
29071990
risk_code
36/37/38
Signal word
Warning

Chemistry & industry

Uses & manufacturing

General Manufacturing Information1-Naphthalenol, 5,6,7,8-tetrahydro-: ACTIVE
Applications · 2 items

Uses5,6,7,8-Tetrahydro-1-naphthol is a useful chemical intermediate, widely applied in organic synthesis and also used as a fuel additive.

Uses5,6,7,8-Tetrahydro-1-naphthalenol was used as a reagent in the synthesis of phosphonamidate and phosphonodiamidate prodrugs of adefovir and tenofovir which are used in the treatment of HIV infections. Also used in the synthesis of tetrahydronaphthalene-1-ol derivatives which were found to be promising potent antitumor agents.

Upstream & downstream products

Suppliers50 total

梯希爱(上海)化成工业发展有限公司021-67121386 · [email protected]
合肥曼奇诺生物医药技术有限公司19719236623 · [email protected]
上海麦克林生化科技股份有限公司021-50706066 15221275939 · [email protected]
Sichuan Biosynce Pharmatech Co., Ltd.[email protected]
上海遐瑞医药科技有限公司+86-021-61551413 · [email protected]

Additional notes

DefinitionChEBI: 5,6,7,8-tetrahydro-1-naphthol is 1-naphthol hydrogenated at C-5, -6, -7 and -8.

Related reactions

90 records
New reaction record

Linked notes

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