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1-(4-DIMETHYLAMINO-BUT-2-YNYL)-PYRROLIDIN-2-ONE

1-(4-DIMETHYLAMINO-BUT-2-YNYL)-PYRROLIDIN-2-ONE structure

CAS No:
3854-02-2
Formula:
C10H16N2O
Chemical Name:
1-(4-DIMETHYLAMINO-BUT-2-YNYL)-PYRROLIDIN-2-ONE
Synonyms:
BR 100;BR-100;1-(4-Dimethylamino-but-2-ynyl)-pyrrolidin-2-one;BR 100 (pharmaceutical);CHEMBL41779;2-Pyrrolidinone, 1-(4-(dimethylamino)-2-butynyl)-;BRN 1527767;1-(4-Dimethylaminobut-2-ynyl)pyrrolid-2-one;1-[4-(DIMETHYLAMINO)BUT-2-YN-1-YL]PYRROLIDIN-2-ONE

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1-(4-DIMETHYLAMINO-BUT-2-YNYL)-PYRROLIDIN-2-ONE Basic Attributes

Molecular Weight：

180.24700

Exact Mass：

180.12600

DSSTox ID：

DTXSID20191868

HScode：

2933790090

Characteristics

PSA：

23.55000

XLogP3：

0.11170

Density：

1.057g/cm3

Boiling Point：

320.9ºC at 760 mmHg

Flash Point：

140.1ºC

Refractive Index：

1.518

Drug Information

MeSH Entry Terms：

BR 100

Computed Properties

Molecular Weight:180.25
XLogP3:-0.1
Hydrogen Bond Acceptor Count:2
Rotatable Bond Count:2
Exact Mass:180.126263138
Monoisotopic Mass:180.126263138
Topological Polar Surface Area:23.6
Heavy Atom Count:13
Complexity:246
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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Guide of 1-(4-DIMETHYLAMINO-BUT-2-YNYL)-PYRROLIDIN-2-ONE

Basic Attributes
Characteristics
Drug Information
Computed Properties

1-(4-DIMETHYLAMINO-BUT-2-YNYL)-PYRROLIDIN-2-ONE

SDS

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