3-Pentanol, 3-ethyl-

Names

[ CAS No. ]:
597-49-9

[ Name ]:
3-Pentanol, 3-ethyl-

[Synonym ]:
EINECS 209-902-0
MFCD00021888
3-ethylpentan-3-ol

Chemical & Physical Properties

[ Density]:
0.824 g/mL at 25 °C(lit.)

[ Boiling Point ]:
141 °C743 mm Hg(lit.)

[ Melting Point ]:
-12.5 °C

[ Molecular Formula ]:
C₇H₁₆O

[ Molecular Weight ]:
116.20100

[ Flash Point ]:
104 °F

[ Exact Mass ]:
116.12000

[ PSA ]:
20.23000

[ LogP ]:
1.94750

[ Index of Refraction ]:
n20/D 1.430(lit.)

[ Storage condition ]:
Flammables area

MSDS

Click to get detail MSDS

Toxicological Information

CHEMICAL IDENTIFICATION

RTECS NUMBER :: SA6780000

CHEMICAL NAME :: 3-Pentanol, 3-ethyl-

CAS REGISTRY NUMBER :: 597-49-9

BEILSTEIN REFERENCE NO. :: 1731643

LAST UPDATED :: 199701

DATA ITEMS CITED :: 2

MOLECULAR FORMULA :: C7-H16-O

MOLECULAR WEIGHT :: 116.23

WISWESSER LINE NOTATION :: QX2&2&2

HEALTH HAZARD DATA

ACUTE TOXICITY DATA

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

ROUTE OF EXPOSURE :: Subcutaneous

SPECIES OBSERVED :: Rodent - mouse

DOSE/DURATION :: 700 mg/kg

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

REFERENCE :: ARZNAD Arzneimittel-Forschung. Drug Research. (Editio Cantor Verlag, Postfach 1255, W-7960 Aulendorf, Fed. Rep. Ger.) V.1- 1951- Volume(issue)/page/year: 5,161,1955

Safety Information

[ Symbol ]:

GHS02, GHS05, GHS07

[ Signal Word ]:
Danger

[ Hazard Statements ]:
H226-H302-H315-H318-H335

[ Precautionary Statements ]:
P261-P280-P305 + P351 + P338

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

[ Hazard Codes ]:
Xn

[ Risk Phrases ]:
R10

[ Safety Phrases ]:
S16

[ RIDADR ]:
UN 1987 3/PG 3

[ WGK Germany ]:
3

[ RTECS ]:
SA6780000

[ Packaging Group ]:
III

[ Hazard Class ]:
3

Synthetic Route

Click to get detail synthetic route

Articles

The effect of alcohol structures on the interaction mode with the hexameric capsule of resorcin[4]arene.

Chemistry 18(27) , 8515-20, (2012)

After more than a century of research on resorcin[4]arenes (1) it is clear that such systems form spontaneously [1(6)(H(2)O)(8)]-type hexameric capsules in wet, non-polar, organic solvents. However, t...

Spectroscopic probing of the effect of alkanols on the properties of the head group region in reverse micelles of AOT-heptane-water.

J. Colloid. Interface Sci. 258(2) , 363-6, (2003)

The effects of addition of alkanols (ethanol, n-hexanol, and 3-ethyl-3-pentanol) on the micropolarity and microviscosity of the head group region in reverse micelles of AOT-heptane-water have been inv...

New t-butyl based aspartate protecting groups preventing aspartimide formation in Fmoc SPPS.

J. Pept. Sci. 21 , 680-7, (2015)

Obtaining homogenous aspartyl-containing peptides via Fmoc/tBu chemistry is often an insurmountable obstacle. A generic solution for this issue utilising an optimised side-chain protection strategy th...