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Ethyl (2E)-3-(1-pyrrolidinyl)-2-butenoate

Ethyl (2E)-3-(1-pyrrolidinyl)-2-butenoate structure

CAS No:
54716-02-8
Formula:
C10H17NO2
Chemical Name:
Ethyl (2E)-3-(1-pyrrolidinyl)-2-butenoate
Synonyms:
2-Butenoic acid,3-(1-pyrrolidinyl)-,ethyl ester,(2E)-;2-Butenoic acid,3-(1-pyrrolidinyl)-,ethyl ester,(E)-;Ethyl (2E)-3-(1-pyrrolidinyl)-2-butenoate;Ethyl acetoacetate pyrrolidinyl enamine;Ethyl (E)-3-(pyrrolidino)-2-butenoate;(E)-Ethyl 3-(pyrrolidin-1-yl)but-2-enoate

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Ethyl (2E)-3-(1-pyrrolidinyl)-2-butenoate Basic Attributes

Molecular Weight：

183.25

Exact Mass：

183.25

BRN：

1310113

EC Number：

259-303-3

Characteristics

PSA：

29.5

XLogP3：

1.7

Density：

1.0±0.1 g/cm3

Melting Point：

25-26 °C

Boiling Point：

110 °C @ Press: 0.02 Torr

Flash Point：

125-126°C/0.8mm

Refractive Index：

1.493

Safety Information

Transport codes：

NONH for all modes of transport

wgk germany：

hazard class code：

36/38-36

safety instructions：

26-36

Marks：

Precautionary statement(s)：

P305 + P351 + P338

Hazard Statements：

H319

GHS Classification：

|Warning|H315 (11.63%): Causes skin irritation [Warning Skin corrosion/irritation]|P264, P280, P302+P352, P305+P351+P338, P321, P332+P313, P337+P313, and P362|Aggregated GHS information provided by 43 companies from 3 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.|H319 (100%): Causes serious eye irritation [Warning Serious eye damage/eye irritation]|P264, P280, P305+P351+P338, and P337+P313|Aggregated GHS information provided by 38 companies from 1 notifications to the ECHA C&L Inventory.

Computed Properties

Molecular Weight:183.25
XLogP3:1.7
Hydrogen Bond Acceptor Count:3
Rotatable Bond Count:4
Exact Mass:183.125928785
Monoisotopic Mass:183.125928785
Topological Polar Surface Area:29.5
Heavy Atom Count:13
Complexity:205
Defined Bond Stereocenter Count:1
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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ETHYL (E)-3-(1-PYRROLIDINO)CROTONATE

CAS No.: 54716-02-8

Content: 99.00%

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Guide of Ethyl (2E)-3-(1-pyrrolidinyl)-2-butenoate

Basic Attributes
Characteristics
Safety Information
Computed Properties
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Ethyl (2E)-3-(1-pyrrolidinyl)-2-butenoate

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