3,4-Dihydronaphthalen-1(2H)-one

Names

[ CAS No. ]:
529-34-0

[ Name ]:
3,4-Dihydronaphthalen-1(2H)-one

[Synonym ]:
a-Tetralone
α-Tetralone
3,4-dihydro-2H-naphthalen-1-one
EINECS 208-460-6
1-TETRALONE pure
1-oxotetrahydronaphthalene
1-oxo-1,2,3,4-tetrahydronaphthalene
3,4-Dihydro-1(2H)-naphthalenone
1(2H)-Naphthalenone, 3,4-dihydro-
2,3,4-Trihydronaphthalen-1-one
alpha-Tetralone
tetralone
3,4-dihydronaphthalen-1(2H)-one
1,2,3,4-tetrahydronaphthalen-1-one
1,2,3,4-Tetrahydro-1-naphthalenone
1-Oxotetralin
Tetralone 1
MFCD00001688
1-tetralone
Tetralole

Biological Activity

[Description]:

3,4-Dihydronaphthalen-1-one is a biochemical reagent that can be used as a biological material or organic compound for life science related research.

[Related Catalog]:

Research Areas >> Others

Signaling Pathways >> Others >> Others

Chemical & Physical Properties

[ Density]:
1.1±0.1 g/cm3

[ Boiling Point ]:
255.8±10.0 °C at 760 mmHg

[ Melting Point ]:
2-7 °C(lit.)

[ Molecular Formula ]:
C₁₀H₁₀O

[ Molecular Weight ]:
146.19

[ Flash Point ]:
104.6±14.0 °C

[ Exact Mass ]:
146.073166

[ PSA ]:
17.07000

[ LogP ]:
2.61

[ Vapour Pressure ]:
0.0±0.5 mmHg at 25°C

[ Index of Refraction ]:
1.564

[ Water Solubility ]:
insoluble

MSDS

Click to get detail MSDS

Toxicological Information

CHEMICAL IDENTIFICATION

RTECS NUMBER :: QK4375000

CHEMICAL NAME :: 1(2H)-Naphthalenone, 3,4-dihydro-

CAS REGISTRY NUMBER :: 529-34-0

BEILSTEIN REFERENCE NO. :: 0607374

LAST UPDATED :: 199710

DATA ITEMS CITED :: 4

MOLECULAR FORMULA :: C10-H10-O

MOLECULAR WEIGHT :: 146.20

WISWESSER LINE NOTATION :: L66 BVT&J

HEALTH HAZARD DATA

ACUTE TOXICITY DATA

TYPE OF TEST :: LD50 - Lethal dose, 50 percent kill

ROUTE OF EXPOSURE :: Oral

SPECIES OBSERVED :: Rodent - rat

DOSE/DURATION :: 810 uL/kg

TOXIC EFFECTS :: Details of toxic effects not reported other than lethal dose value

REFERENCE :: AIHAAP American Industrial Hygiene Association Journal. (AIHA, 475 Wolf Ledges Pkwy., Akron, OH 44311) V.19- 1958- Volume(issue)/page/year: 30,470,1969

TYPE OF TEST :: LD50 - Lethal dose, 50 percent kill

ROUTE OF EXPOSURE :: Administration onto the skin

SPECIES OBSERVED :: Rodent - rabbit

DOSE/DURATION :: >2 mL/kg

TOXIC EFFECTS :: Details of toxic effects not reported other than lethal dose value

REFERENCE :: TXAPA9 Toxicology and Applied Pharmacology. (Academic Press, Inc., 1 E. First St., Duluth, MN 55802) V.1- 1959- Volume(issue)/page/year: 28,313,1974

Safety Information

[ Symbol ]:

GHS07

[ Signal Word ]:
Warning

[ Hazard Statements ]:
H302

[ Precautionary Statements ]:
P301 + P312 + P330

[ Personal Protective Equipment ]:
Eyeshields;Faceshields;full-face respirator (US);Gloves;multi-purpose combination respirator cartridge (US);type ABEK (EN14387) respirator filter

[ Hazard Codes ]:
Xn:Harmful

[ Risk Phrases ]:
R20/22

[ Safety Phrases ]:
S23-S24/25

[ RIDADR ]:
NONH for all modes of transport

[ WGK Germany ]:
3

[ RTECS ]:
QK4375000

[ Packaging Group ]:
I; II; III

[ HS Code ]:
29143900

Synthetic Route

Click to get detail synthetic route

Precursor & DownStream

Precursor

DownStream

Customs

[ HS Code ]: 29143900

Articles

Quantitative structure-activity relationship analysis of inhibitors of the nicotine metabolizing CYP2A6 enzyme.

J. Med. Chem. 48 , 440-9, (2005)

The purpose of this study was to develop screening and in silico modeling methods to obtain accurate information on the active center of CYP2A6, a nicotine oxidizing enzyme. The inhibitory potencies o...

Exploring QSAR and QAAR for inhibitors of cytochrome P450 2A6 and 2A5 enzymes using GFA and G/PLS techniques

Eur. J. Med. Chem. 44 , 1941-51, (2009)

A series of naphthalene and non-naphthalene derivatives ( n = 42) having cytochrome P450 2A6 and 2A5 inhibitory activities, reported by Rahnasto et al., were subjected to QSAR and QAAR studies. The an...