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Ethyl 5-(ethoxycarbonyl)-2,4-dimethyl-1H-pyrrole-3-propanoate

Ethyl 5-(ethoxycarbonyl)-2,4-dimethyl-1H-pyrrole-3-propanoate structure

CAS No:
54278-10-3
Formula:
C14H21NO4
Chemical Name:
Ethyl 5-(ethoxycarbonyl)-2,4-dimethyl-1H-pyrrole-3-propanoate
Synonyms:
1H-Pyrrole-3-propanoic acid,5-(ethoxycarbonyl)-2,4-dimethyl-,ethyl ester;Pyrrole-3-propionic acid,5-carboxy-2,4-dimethyl-,diethyl ester;Ethyl 5-(ethoxycarbonyl)-2,4-dimethyl-1H-pyrrole-3-propanoate;2-Ethoxycarbonyl-4-(2-ethoxycarbonylethyl)-3,5-dimethylpyrrole;NSC 157290

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Description

White or white crystalline

Ethyl 5-(ethoxycarbonyl)-2,4-dimethyl-1H-pyrrole-3-propanoate Basic Attributes

Molecular Weight：

267.32

Exact Mass：

267.32

NSC Number：

157290

DSSTox ID：

DTXSID10303190

HScode：

2933990090

Characteristics

PSA：

68.4

XLogP3：

2.5

Density：

1.111 g/cm3

Melting Point：

73 °C

Boiling Point：

165-170 °C @ Press: 0.02 Torr

Flash Point：

189.5ºC

Refractive Index：

1.51

Safety Information

Hazard category：

IRRITANT

wgk germany：

hazard class code：

36/37/38

safety instructions：

26-37/39

Marks：

Hazard note：

Irritant

Precautionary statement(s)：

P261, P264, P271, P280, P302+P352, P304+P340, P305+P351+P338, P312, P321, P332+P313, P337+P313, P362, P403+P233, P405, P501

Hazard Statements：

H315

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 38 companies from 1 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.

Computed Properties

Molecular Weight:267.32
XLogP3:2.5
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:4
Rotatable Bond Count:8
Exact Mass:267.14705815
Monoisotopic Mass:267.14705815
Topological Polar Surface Area:68.4
Heavy Atom Count:19
Complexity:319
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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Guide of Ethyl 5-(ethoxycarbonyl)-2,4-dimethyl-1H-pyrrole-3-propanoate

Description
Basic Attributes
Characteristics
Safety Information
Computed Properties
Learn More Other Chemicals

Ethyl 5-(ethoxycarbonyl)-2,4-dimethyl-1H-pyrrole-3-propanoate

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