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2-Methylenehexanal

2-Methylenehexanal structure

CAS No:
1070-66-2
Formula:
C7H12O
Chemical Name:
2-Methylenehexanal
Synonyms:
Hexanal,2-methylene-;2-Methylenehexanal;α-Butylacrolein;2-Butylacrolein;2-n-Butyl acrolein;2-Methylidenehexanal

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2-Methylenehexanal Basic Attributes

Molecular Weight：

112.16958

Exact Mass：

112.17

EC Number：

213-978-0

DSSTox ID：

DTXSID80147866

Characteristics

PSA：

17.1

XLogP3：

2.2

Density：

0.8408 g/cm³ @ Temp: 20 °C

Boiling Point：

53-55 °C @ Press: 30 Torr

Safety Information

Packing level：

III

Hazard category：

3.2

Transport codes：

1993

Precautionary statement(s)：

P210, P233, P240, P241, P242, P243, P261, P264, P270, P271, P280, P301+P312, P302+P352, P303+P361+P353, P304+P312, P304+P340, P305+P351+P338, P312, P322, P330, P337+P313, P363, P370+P378, P403+P233, P403+P235, P405, P501

Hazard Statements：

H226

GHS Classification：

|Warning|H226 (100%): Flammable liquid and vapor [Warning Flammable liquids]|P210, P233, P240, P241, P242, P243, P261, P264, P270, P271, P280, P301+P312, P302+P352, P303+P361+P353, P304+P312, P304+P340, P305+P351+P338, P312, P322, P330, P337+P313, P363, P370+P378, P403+P233, P403+P235, P405, and P501|Aggregated GHS information provided by 38 companies from 1 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.

Drug Information

MeSH Entry Terms：

2-butylacrolein

Computed Properties

Molecular Weight:112.17
XLogP3:2.2
Hydrogen Bond Acceptor Count:1
Rotatable Bond Count:4
Exact Mass:112.088815002
Monoisotopic Mass:112.088815002
Topological Polar Surface Area:17.1
Heavy Atom Count:8
Complexity:84.4
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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Guide of 2-Methylenehexanal

Basic Attributes
Characteristics
Safety Information
Drug Information
Computed Properties

2-Methylenehexanal

SDS

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