δ-Dodecalactone

Names

[ CAS No. ]:
713-95-1

[ Name ]:
δ-Dodecalactone

[Synonym ]:
i-dodecanolactone
DODECANOLACTONE
EINECS 211-932-4
6-heptyltetrahydropyran-2-one
D-DODECALACTONE
dl-6-heptyltetrahydropyran-2-one
Dodecan-5-olide
MFCD00006651
6-heptylvalerolactone
6-Heptyltetrahydro-2H-pyran-2-one
5-dodecalactone
d-Dodecanolactone
FEMA 2401
UNII:33DIC582TL
2H-Pyran-2-one, 6-heptyltetrahydro-
Dodecan-5-olid
(±)-δ-Heptyl-δ-valerolactone

Chemical & Physical Properties

[ Density]:
0.9±0.1 g/cm3

[ Boiling Point ]:
295.2±8.0 °C at 760 mmHg

[ Melting Point ]:
−12 °C(lit.)

[ Molecular Formula ]:
C₁₂H₂₂O₂

[ Molecular Weight ]:
198.302

[ Flash Point ]:
119.8±15.9 °C

[ Exact Mass ]:
198.161987

[ PSA ]:
26.30000

[ LogP ]:
3.48

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

[ Index of Refraction ]:
1.448

MSDS

Click to get detail MSDS

Toxicological Information

CHEMICAL IDENTIFICATION

RTECS NUMBER :: UQ0850000

CHEMICAL NAME :: 2H-Pyran-2-one, 6-heptyltetrahydro-

CAS REGISTRY NUMBER :: 713-95-1

LAST UPDATED :: 199701

DATA ITEMS CITED :: 4

MOLECULAR FORMULA :: C12-H22-O2

MOLECULAR WEIGHT :: 198.34

WISWESSER LINE NOTATION :: T6OVTJ F7

HEALTH HAZARD DATA

ACUTE TOXICITY DATA

TYPE OF TEST :: Standard Draize test

ROUTE OF EXPOSURE :: Administration onto the skin

SPECIES OBSERVED :: Rodent - rabbit

REFERENCE :: FCTXAV Food and Cosmetics Toxicology. (London, UK) V.1-19, 1963-81. For publisher information, see FCTOD7. Volume(issue)/page/year: 17,773,1979 ** ACUTE TOXICITY DATA **

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

ROUTE OF EXPOSURE :: Oral

SPECIES OBSERVED :: Rodent - rat

DOSE/DURATION :: >5 gm/kg

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

REFERENCE :: FCTXAV Food and Cosmetics Toxicology. (London, UK) V.1-19, 1963-81. For publisher information, see FCTOD7. Volume(issue)/page/year: 17,773,1979

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

ROUTE OF EXPOSURE :: Administration onto the skin

SPECIES OBSERVED :: Rodent - rabbit

DOSE/DURATION :: >5 gm/kg

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

REFERENCE :: FCTXAV Food and Cosmetics Toxicology. (London, UK) V.1-19, 1963-81. For publisher information, see FCTOD7. Volume(issue)/page/year: 17,773,1979

Safety Information

[ Symbol ]:

GHS07

[ Signal Word ]:
Warning

[ Hazard Statements ]:
H315-H319-H335

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

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

[ Hazard Codes ]:
Xi:Irritant

[ Risk Phrases ]:
R36/37/38

[ Safety Phrases ]:
S26-S37/39

[ RIDADR ]:
NONH for all modes of transport

[ WGK Germany ]:
2

[ RTECS ]:
UQ0850000

Synthetic Route

Click to get detail synthetic route

Precursor & DownStream

Precursor

DownStream

Articles

Ti-Catalyzed Regiodivergent Openings of Unbiased Epoxides. Gansäuer A, et al.

Synfacts 2007(06) , 0629, (2007)

Mosciano, G.

Perfum. Flavor. 3rd ed., 21 , 52, (1996)