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2,4-Dimethyl-3-ethylpyrrole

2,4-Dimethyl-3-ethylpyrrole structure

CAS No:
517-22-6
Formula:
C8H13N
Chemical Name:
2,4-Dimethyl-3-ethylpyrrole
Synonyms:
1H-Pyrrole,3-ethyl-2,4-dimethyl-;Pyrrole,3-ethyl-2,4-dimethyl-;3-Ethyl-2,4-dimethyl-1H-pyrrole;Cryptopyrrole;2,4-Dimethyl-3-ethylpyrrole;Kryptopyrrole;3-Ethyl-2,4-dimethylpyrrole;Kryptopyrrol;NSC 62025;2,4-Dimethyl-3-ethyl-1H-pyrrole
Categories:
Flavors and Fragrances > Synthetic Fragrances

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Description

clear yellow to red-brown liquid

2,4-Dimethyl-3-ethylpyrrole Basic Attributes

Molecular Weight：

123.2

Exact Mass：

123.20

EC Number：

208-234-7

UNII：

339V6S6PPS

NSC Number：

62025

DSSTox ID：

DTXSID20199647

HScode：

2933990090

Characteristics

PSA：

15.8

XLogP3：

2.3

Appearance：

Clear yellow to red-brown Liquid

Density：

0.913 g/mL at 25 °C(lit.)

Melting Point：

0 °C

Boiling Point：

199 °C

Flash Point：

161 °F

Refractive Index：

n20/D 1.496(lit.)

Storage Conditions：

0-6°C

Safety Information

wgk germany：

hazard class code：

36/37/38

safety instructions：

26-36-37/39

RTECS Number：

UX9629500

Marks：

Stability/Shelf Life：

Stable at room temperature in closed containers under normal storage and handling conditions.

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

Drug Information

MeSH Entry Terms：

2,4-dimethyl-3-ethylpyrrole

2,4-Dimethyl-3-ethylpyrrole Use and Manufacturing

3-Ethyl-2,4-dimethyl-1H-pyrrole is a important diagnostic compound for pyrrole disorder or pyroluria, an abnormality in biochemistry resulting in overproduction of pyrrole molecules and resulting in improper hemoglobin synthesis.

Computed Properties

Molecular Weight:123.20
XLogP3:2.3
Hydrogen Bond Donor Count:1
Rotatable Bond Count:1
Exact Mass:123.104799419
Monoisotopic Mass:123.104799419
Topological Polar Surface Area:15.8
Heavy Atom Count:9
Complexity:90.6
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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2,4-Dimethyl-3-ethylpyrrole

CAS No.: 517-22-6

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Guide of 2,4-Dimethyl-3-ethylpyrrole

Description
Basic Attributes
Characteristics
Safety Information
Drug Information
Use and Manufacturing
Computed Properties
Recommended Suppliers
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2,4-Dimethyl-3-ethylpyrrole

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