4-Undecanolide

Names

[ CAS No. ]:
104-67-6

[ Name ]:
4-Undecanolide

[Synonym ]:
EINECS 203-225-4
rersicol
UNII:QB1T0AG2YL
γ-Heptyl-γ-butyrolactone
Peach
4-Hydroxyundecanoic acid, γ-lactone
4-Undecanolide
Dihydro-5-heptyl-2(3H)-furanone
Persicol
γ-Undecanolide
FEMA 3091
5-heptyl-dihydro-furan-2-one
ALDEHYDE C-14
1,4-Undecanolide
Undecan-4-olide
Undecanoic γ-lactone
5-Heptyldihydro-2(3H)-furanone
γ-Undecanolactone
gamma-Undecalactone
PEACH ALDEHYDE
2(3H)-Furanone, 5-heptyldihydro-
5-Heptyldihydrofuran-2(3H)-one
γ-Undecalactone
Peach lactone
undecan-4
5-heptyl-2-tetrahydrofuranone
4-Hydroxyundecanoic acid lactone
γ-Heptylbutyrolactone
Aldehyde C14
gamma-Undecanolactone
MFCD00005405
Undecanoic acid, 4-hydroxy-, γ-lactone

Biological Activity

[Description]:

5-Heptyldihydrofuran-2(3H)-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

Chemical & Physical Properties

[ Density]:
0.9±0.1 g/cm3

[ Boiling Point ]:
286.0±0.0 °C at 760 mmHg

[ Molecular Formula ]:
C₁₁H₂₀O₂

[ Molecular Weight ]:
184.275

[ Flash Point ]:
112.7±15.9 °C

[ Exact Mass ]:
184.146332

[ PSA ]:
26.30000

[ LogP ]:
2.92

[ Vapour Pressure ]:
0.0±0.6 mmHg at 25°C

[ Index of Refraction ]:
1.449

MSDS

Click to get detail MSDS

Toxicological Information

CHEMICAL IDENTIFICATION

RTECS NUMBER :: YQ2485000

CHEMICAL NAME :: Undecanoic acid, 4-hydroxy-, gamma-lactone

CAS REGISTRY NUMBER :: 104-67-6

BEILSTEIN REFERENCE NO. :: 0081943

LAST UPDATED :: 199707

DATA ITEMS CITED :: 8

MOLECULAR FORMULA :: C11-H20-O2

MOLECULAR WEIGHT :: 184.31

WISWESSER LINE NOTATION :: T5OVTJ E7

HEALTH HAZARD DATA

ACUTE TOXICITY DATA

TYPE OF TEST :: Standard Draize test

ROUTE OF EXPOSURE :: Administration onto the skin

SPECIES OBSERVED :: Rodent - rabbit

TYPE OF TEST :: Standard Draize test

ROUTE OF EXPOSURE :: Administration onto the skin

SPECIES OBSERVED :: Rodent - guinea pig

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

ROUTE OF EXPOSURE :: Oral

SPECIES OBSERVED :: Rodent - rat

DOSE/DURATION :: 18500 mg/kg

TOXIC EFFECTS :: Behavioral - somnolence (general depressed activity) Skin and Appendages - hair

MUTATION DATA

TYPE OF TEST :: DNA repair

TEST SYSTEM :: Bacteria - Bacillus subtilis

DOSE/DURATION :: 10 mg/disc

REFERENCE :: OIGZDE Osaka-shi Igakkai Zasshi. Journal of Osaka City Medical Association. (Osaka-shi Igakkai, c/o Osaka-shiritsu Daigaku Igakubu, 1-4-54 Asahi-cho, Abeno-ku, Osaka, 545, Japan) V.24- 1975- Volume(issue)/page/year: 34,267,1985 *** U.S. STANDARDS AND REGULATIONS *** EPA FIFRA 1988 PESTICIDE SUBJECT TO REGISTRATION OR RE-REGISTRATION FEREAC Federal Register. (U.S. Government Printing Office, Supt. of Documents, Washington, DC 20402) V.1- 1936- Volume(issue)/page/year: 54,7740,1989 *** NIOSH STANDARDS DEVELOPMENT AND SURVEILLANCE DATA *** NIOSH OCCUPATIONAL EXPOSURE SURVEY DATA : NOHS - National Occupational Hazard Survey (1974) NOHS Hazard Code - M4905 No. of Facilities: 18 (estimated) No. of Industries: 1 No. of Occupations: 13 No. of Employees: 3245 (estimated) NOES - National Occupational Exposure Survey (1983) NOES Hazard Code - M4905 No. of Facilities: 4449 (estimated) No. of Industries: 23 No. of Occupations: 35 No. of Employees: 49792 (estimated) No. of Female Employees: 21526 (estimated)

Safety Information

[ Symbol ]:

GHS07

[ Signal Word ]:
Warning

[ Hazard Statements ]:
H315-H319-H335-H412

[ Precautionary Statements ]:
P261-P273-P305 + P351 + P338

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

[ Hazard Codes ]:
Xi:Irritant;

[ Risk Phrases ]:
R36/37/38

[ Safety Phrases ]:
S26-S36-S37/39-S36/37

[ RIDADR ]:
NONH for all modes of transport

[ WGK Germany ]:
3

[ RTECS ]:
YQ2485000

[ HS Code ]:
2932209090

Synthetic Route

Click to get detail synthetic route

Precursor & DownStream

Precursor

DownStream

Customs

[ HS Code ]: 2932209090

[ Summary ]:
2932209090. other lactones. VAT:17.0%. Tax rebate rate:13.0%. . MFN tariff:6.5%. General tariff:20.0%

Articles

Predictive three-dimensional quantitative structure-activity relationship of cytochrome P450 1A2 inhibitors.

J. Med. Chem. 48 , 3808-15, (2005)

The purpose of this study was to determine the cytochrome P450 1A2 (CYP1A2) inhibition potencies of structurally diverse compounds to create a comprehensive three-dimensional quantitative structure-ac...