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N-[[(8β)-6-Methylergolin-8-yl]methyl]acetamide

N-[[(8β)-6-Methylergolin-8-yl]methyl]acetamide structure

CAS No:
3031-48-9
Formula:
C18H23N3O
Chemical Name:
N-[[(8β)-6-Methylergolin-8-yl]methyl]acetamide
Synonyms:
Acetamide,N-[[(8β)-6-methylergolin-8-yl]methyl]-;Acetamide,N-[(6-methylergolin-8β-yl)methyl]-,(+)-;Lysergamine,N-acetyl-9,10-dihydro-;N-[[(8β)-6-Methylergolin-8-yl]methyl]acetamide;Acetergamine;(+)-N-Acetyl-9,10-dihydrolysergamine;8β-Acetylaminomethyl-6-methylergoline;16409-67-9

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N-[[(8β)-6-Methylergolin-8-yl]methyl]acetamide Basic Attributes

Molecular Weight：

297.39

Exact Mass：

297.39

EC Number：

221-207-4

UNII：

O60O0JB93O

Characteristics

PSA：

51.62000

XLogP3：

3.04220

Density：

1.170±0.06 g/cm3

Boiling Point：

558.0±40.0 °C(Predicted)

Flash Point：

291.3ºC

Refractive Index：

1.613

PKA：

16.23±0.46

Drug Information

MeSH Entry Terms：

acetergamine

Computed Properties

Molecular Weight:297.4
XLogP3:1.9
Hydrogen Bond Donor Count:2
Hydrogen Bond Acceptor Count:2
Rotatable Bond Count:2
Exact Mass:297.184112366
Monoisotopic Mass:297.184112366
Topological Polar Surface Area:48.1
Heavy Atom Count:22
Complexity:440
Defined Atom Stereocenter Count:3
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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Guide of N-[[(8β)-6-Methylergolin-8-yl]methyl]acetamide

Basic Attributes
Characteristics
Drug Information
Computed Properties

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