16429-21-3

16429-21-3 structure
16429-21-3 structure

Name 7-hexyloxepan-2-one
Synonyms MFCD00006651
7-hexylcaprolactone
6-dodecanolide
7-(R,S)-hexyloxepan-2-one
2-Oxepanone,7-hexyl
7-Hexyl-2-oxepanone
FEMA No. 3610
EINECS 211-932-4
EINECS 240-483-7
6-Hexylhexanolide
Density 0.942 g/mL at 25 °C(lit.)
Boiling Point 140-141 °C1 mm Hg(lit.)
Melting Point −12 °C(lit.)
Molecular Formula C12H22O2
Molecular Weight 198.30200
Flash Point >230 °F
Exact Mass 198.16200
PSA 26.30000
LogP 3.44260
Vapour Pressure 0.0015mmHg at 25°C
Index of Refraction n20/D 1.460(lit.)

CHEMICAL IDENTIFICATION

RTECS NUMBER :
RQ6710000
CHEMICAL NAME :
2-Oxepanone, 7-hexyl-
CAS REGISTRY NUMBER :
16429-21-3
LAST UPDATED :
199612
DATA ITEMS CITED :
1
MOLECULAR FORMULA :
C12-H22-O2
MOLECULAR WEIGHT :
198.34
WISWESSER LINE NOTATION :
T7OVTJ G6

HEALTH HAZARD DATA

ACUTE TOXICITY DATA

TYPE OF TEST :
LD50 - Lethal dose, 50 percent kill
ROUTE OF EXPOSURE :
Oral
SPECIES OBSERVED :
Rodent - mouse
DOSE/DURATION :
7898 mg/kg
TOXIC EFFECTS :
Details of toxic effects not reported other than lethal dose value
REFERENCE :
DCTODJ Drug and Chemical Toxicology. (Marcel Dekker, 270 Madison Ave., New York, NY 10016) V.1- 1977/78- Volume(issue)/page/year: 3,249,1980
Hazard Codes Xi: Irritant;
Risk Phrases 36/37/38
Safety Phrases S26-S37/39
WGK Germany 2
RTECS UQ0850000
HS Code 2932209090
Precursor  2

DownStream  0

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