2-Propen-1-yl 2-cyanoacetate
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2-Propen-1-yl 2-cyanoacetate
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CAS No:
13361-32-5
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Formula:
C6H7NO2
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Chemical Name:
2-Propen-1-yl 2-cyanoacetate
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Synonyms:
Acetic acid,2-cyano-,2-propen-1-yl ester;Acetic acid,cyano-,allyl ester;Acetic acid,cyano-,2-propenyl ester;2-Propen-1-yl 2-cyanoacetate;Cyanoacetic acid allyl ester;Allyl cyanoacetate;Allyl 2-cyanoacetate
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CAS No:
2-Propen-1-yl 2-cyanoacetate Basic Attributes
125.13
125.13
236-423-4
6A64N945D8
DTXSID1065425
2926909090
Characteristics
50.1
0.42
Liquid
1.0±0.1 g/cm3
89-90 °C @ Press: 3.8 Torr
>230 °F
1.436
Store below +30°C.
0.118mmHg at 25°C
Oral-rat LD50: 160 mg/kg
Flammable; burning produces toxic nitrogen oxide fumes
Safety Information
III
6.1(b)
UN 3276 6.1/PG 3
3
20/21/22-36/37/38
26-28-36/37/39-45
AG3690000
Xn
Treasury is ventilated, low temperature and dry; stored separately from food materials
P261-P280-P301 + P310-P305 + P351 + P338
H301-H312-H315-H319-H332-H335
|Danger|H301 (100%): Toxic if swallowed [Danger Acute toxicity, oral]|P261, P264, P270, P271, P280, P301+P310, P302+P352, P304+P312, P304+P340, P305+P351+P338, P312, P321, P322, P330, P332+P313, P337+P313, P362, P363, P403+P233, P405, and P501|Aggregated GHS information provided by 55 companies from 5 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.
2-Propen-1-yl 2-cyanoacetate Use and Manufacturing
Allyl cyanoacetate is an intermediate for special adhesives. Product Data Sheet
Acetic acid, 2-cyano-, 2-propen-1-yl ester: ACTIVE
Computed Properties
Molecular Weight:125.13
XLogP3:0.6
Hydrogen Bond Acceptor Count:3
Rotatable Bond Count:4
Exact Mass:125.047678466
Monoisotopic Mass:125.047678466
Topological Polar Surface Area:50.1
Heavy Atom Count:9
Complexity:154
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
Recommended Suppliers of 2-Propen-1-yl 2-cyanoacetate
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CN
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