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7-Methyl-1,6-octadiene

7-Methyl-1,6-octadiene structure

CAS No:
42152-47-6
Formula:
C9H16
Chemical Name:
7-Methyl-1,6-octadiene
Synonyms:
1,6-Octadiene,7-methyl-;7-Methyl-1,6-octadiene
Categories:
Chemical Reagents > Organic Reagents

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7-Methyl-1,6-octadiene Basic Attributes

Molecular Weight：

124.22

Exact Mass：

124.22

EC Number：

404-210-7

DSSTox ID：

DTXSID0068367

HScode：

2901299090

Characteristics

PSA：

XLogP3：

3.30890

Density：

0.7533 g/cm³ @ Temp: 20 °C

Melting Point：

-70.83°C (estimate)

Boiling Point：

143.3-144.1 °C

Flash Point：

79 °F

Refractive Index：

n20/D 1.436(lit.)

Safety Information

Packing level：

III

Hazard category：

3.2

Transport codes：

UN 3295 3/PG 3

wgk germany：

hazard class code：

10-50/53

safety instructions：

60-61

Marks：

Precautionary statement(s)：

P210, P233, P240, P241, P242, P243, P273, P280, P303+P361+P353, P370+P378, P391, P403+P235, P501

Hazard Statements：

H226

GHS Classification：

|Warning|H226: Flammable liquid and vapor [Warning Flammable liquids]|P210, P233, P240, P241, P242, P243, P273, P280, P303+P361+P353, P370+P378, P391, P403+P235, and P501|H226 (100%): Flammable liquid and vapor [Warning Flammable liquids]|Aggregated GHS information provided by 38 companies from 1 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.|P210, P233, P240, P241, P242, P243, P280, P303+P361+P353, P370+P378, P403+P235, and P501

7-Methyl-1,6-octadiene Use and Manufacturing

Manufacturing Info：

1,6-Octadiene, 7-methyl-: INACTIVE|PMN - indicates a commenced PMN (Pre-Manufacture Notices) substance.

Computed Properties

Molecular Weight:124.22
XLogP3:3.8
Rotatable Bond Count:4
Exact Mass:124.125200510
Monoisotopic Mass:124.125200510
Heavy Atom Count:9
Complexity:94.6
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

Material

Tetrahydrofuran

Isobutylene

Acetone