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252808

Sigma-Aldrich

Octyl chloroformate

97%

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About This Item

Linear Formula:
ClCO2(CH2)7CH3
CAS Number:
7452-59-7
Molecular Weight:
192.68
EC Number:
231-224-9
MDL number:
MFCD00000652
UNSPSC Code:
12352100
PubChem Substance ID:
24855239
Pricing and availability is not currently available.

vapor pressure

0.39 psi ( 20 °C)

Assay

97%

form

liquid

refractive index

n20/D 1.431 (lit.)

bp

90-91 °C/11 mmHg (lit.)

density

0.984 g/mL at 25 °C (lit.)

storage temp.

2-8°C

SMILES string

CCCCCCCCOC(Cl)=O

InChI

1S/C9H17ClO2/c1-2-3-4-5-6-7-8-12-9(10)11/h2-8H2,1H3

InChI key

VFXVAXFIFHSGNR-UHFFFAOYSA-N

Application

Octyl chloroformate has been used in preparation of:
  • octyl 4-[(tetrahydropyran-2-yl)oxy]but-2-ynoate[1]
  • octyl 4-methoxybut-2-ynoate[1]
  • octyl 4,4-diethoxybut-2-ynoate[1]
  • N-octyloxycarbonyl-R110[2]

Pictograms

Skull and crossbonesCorrosion
GHS06,GHS05

Signal Word

Danger

Hazard Statements

H301 + H311 + H331,H314

Hazard Classifications

Acute Tox. 3 Oral - Skin Corr. 1B

Storage Class Code

6.1A - Combustible acute toxic Cat. 1 and 2 / very toxic hazardous materials

WGK

WGK 3

Flash Point(F)

168.8 °F - closed cup

Flash Point(C)

76 °C - closed cup

Personal Protective Equipment

dust mask type N95 (US), Eyeshields, Gloves

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Certificates of Analysis (COA)

Lot/Batch Number
SHBG6934V
SHBF0698V
SHBB8123V
09896CPV
09896CP

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Regio-and enantioselective synthesis of allenic esters by samarium (II)-mediated reduction of propargylic compounds through dynamic kinetic protonation.
Mikami K and Yoshida A.
Tetrahedron, 57(5), 889-898 (2001)
S X Cai et al.
Bioorganic & medicinal chemistry letters, 11(1), 39-42 (2001-01-05)
N-Octyloxycarbonyl-R110 (1), with enhanced cell penetration and retention properties, was prepared from rhodamine 110. The tetrapeptide substrate N-Ac-DEVD-N'-octyloxycarbonyl-R110 (3) was prepared and shown to be efficiently cleaved by human recombinant caspase-3 and by apoptotic HL-60 cells. This substrate should prove
Tomáš Hložek et al.
Journal of analytical toxicology, 40(9), 749-753 (2016-09-04)
A simple, sensitive and robust method for simultaneous determination of antiepileptic drugs (gabapentin, pregabalin and vigabatrin) in human serum using GC-MS was developed and validated for clinical toxicology purposes. This method employs an emerging class of derivatization agents - alkyl

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