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3,3-Diethoxypropionitrile

3,3-Diethoxypropionitrile structure

CAS No:
2032-34-0
Formula:
C7H13NO2
Chemical Name:
3,3-Diethoxypropionitrile
Synonyms:
Propanenitrile,3,3-diethoxy-;Acetaldehyde,cyano-,diethyl acetal;3,3-Diethoxypropanenitrile;Malonaldehydenitrile diethyl acetal;3,3-Diethoxypropionitrile;Cyanoacetaldehyde diethylacetal
Categories:
Chemical Reagents > Organic Reagents

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Description

CLEAR YELLOW TO BROWNISH LIQUID

3,3-Diethoxypropionitrile Basic Attributes

Molecular Weight：

143.18

Exact Mass：

143.18

EC Number：

217-988-6

DSSTox ID：

DTXSID70174207

HScode：

29269095

Characteristics

PSA：

42.2

XLogP3：

0.5

Density：

0.9496 g/cm³ @ Temp: 20 °C

Melting Point：

82-84

Boiling Point：

99 °C @ Press: 14 Torr

Flash Point：

183 °F

Refractive Index：

1.417

Storage Conditions：

Store below +30°C.

Safety Information

Packing level：

I; II; III

Transport codes：

3275

wgk germany：

hazard class code：

36/37/38

safety instructions：

26-36

Marks：

Hazard note：

Irritant

Precautionary statement(s)：

P261-P305 + P351 + P338

Hazard Statements：

H315-H319-H335

GHS Classification：

|Warning|H315 (100%): Causes skin irritation [Warning Skin corrosion/irritation]|P261, P264, P271, P280, P302+P352, P304+P340, P305+P351+P338, P312, P321, P332+P313, P337+P313, P362, P403+P233, P405, and P501|Aggregated GHS information provided by 41 companies from 4 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.

3,3-Diethoxypropionitrile Use and Manufacturing

3,3-Diethoxypropionitrile is a propionitrile derivative used in the preparation of various biologically active compounds such as p38α mitogen-activated protein kinase inhibitors.

Computed Properties

Molecular Weight:143.18
XLogP3:0.5
Hydrogen Bond Acceptor Count:3
Rotatable Bond Count:5
Exact Mass:143.094628657
Monoisotopic Mass:143.094628657
Topological Polar Surface Area:42.2
Heavy Atom Count:10
Complexity:110
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

Downstream Products

Ethanol

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3,3-Diethoxypropionitrile

CAS No.: 2032-34-0

Content: 99.00%

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CAS No.: 2032-34-0

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Guide of 3,3-Diethoxypropionitrile

Description
Basic Attributes
Characteristics
Safety Information
Use and Manufacturing
Computed Properties
Downstream Products
Recommended Suppliers
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3,3-Diethoxypropionitrile

SDS

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