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Pargolol

Pargolol structure

CAS No:
47082-97-3
Formula:
C16H23NO3
Chemical Name:
Pargolol
Synonyms:
2-Propanol,1-[(1,1-dimethylethyl)amino]-3-[2-(2-propyn-1-yloxy)phenoxy]-;2-Propanol,1-[(1,1-dimethylethyl)amino]-3-[2-(2-propynyloxy)phenoxy]-;1-[(1,1-Dimethylethyl)amino]-3-[2-(2-propyn-1-yloxy)phenoxy]-2-propanol;Pargolol;1-(tert-Butylamino)-3-(2-(prop-2-ynyloxy)phenoxy)propan-2-ol;91476-08-3
Categories:
Organic Chemistry > Amides

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Pargolol Basic Attributes

Molecular Weight：

277.35900

Exact Mass：

277.36

Characteristics

PSA：

50.72000

XLogP3：

2.21730

Density：

1.066g/cm3

Boiling Point：

418ºC

Flash Point：

206.6ºC

Refractive Index：

1.524

Drug Information

MeSH Entry Terms：

1-(tert-butylamino)-3-((2-propynyloxy)phenoxy)-2-propanol.HCl

Computed Properties

Molecular Weight:277.36
XLogP3:2.3
Hydrogen Bond Donor Count:2
Hydrogen Bond Acceptor Count:4
Rotatable Bond Count:8
Exact Mass:277.16779360
Monoisotopic Mass:277.16779360
Topological Polar Surface Area:50.7
Heavy Atom Count:20
Complexity:315
Undefined Atom Stereocenter Count:1
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes