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Octyl carbonochloridate

Octyl carbonochloridate structure

CAS No:
7452-59-7
Formula:
C9H17ClO2
Chemical Name:
Octyl carbonochloridate
Synonyms:
Carbonochloridic acid,octyl ester;Formic acid,chloro-,octyl ester;Octyl carbonochloridate;Octyl chloroformate;1-Octyl chloroformate;n-Octyl chloroformate
Categories:
Chemical Reagents > Organic Reagents

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Description

CLEAR COLOURLESS LIQUID

Octyl carbonochloridate Basic Attributes

Molecular Weight：

192.68300

Exact Mass：

192.68

EC Number：

231-224-9

DSSTox ID：

DTXSID9064710

HScode：

2915900090

Characteristics

PSA：

26.30000

XLogP3：

3.72230

Density：

0.984

Boiling Point：

119-123 °C @ Press: 30 Torr

Flash Point：

75ºC

Refractive Index：

1.43-1.432

Vapor Pressure：

0.39 psi ( 20 °C)

Safety Information

Packing level：

Hazard category：

6.1(a)

Transport codes：

UN 2742

wgk germany：

hazard class code：

34-23-23/24/25

safety instructions：

45-36/37/39-26-27

Marks：

Precautionary statement(s)：

P261-P280-P301 + P310-P305 + P351 + P338-P310

Hazard Statements：

H301 + H311 + H331-H314

GHS Classification：

|Danger|H301 (95%): Toxic if swallowed [Danger Acute toxicity, oral]|P260, P261, P264, P270, P271, P280, P301+P310, P301+P330+P331, P302+P352, P303+P361+P353, P304+P340, P305+P351+P338, P310, P311, P312, P321, P322, P330, P361, P363, P403+P233, P405, and P501|Aggregated GHS information provided by 40 companies from 3 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.

Octyl carbonochloridate Use and Manufacturing

Manufacturing Info：

Carbonochloridic acid, octyl ester: ACTIVE

Computed Properties

Molecular Weight:192.68
XLogP3:4.5
Hydrogen Bond Acceptor Count:2
Rotatable Bond Count:8
Exact Mass:192.0917075
Monoisotopic Mass:192.0917075
Topological Polar Surface Area:26.3
Heavy Atom Count:12
Complexity:115
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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CAS No.: 7452-59-7

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