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1'-Hydroxy Bufuralol

1'-Hydroxy Bufuralol structure

CAS No:
57704-16-2
Formula:
C16H23NO3
Chemical Name:
1'-Hydroxy Bufuralol
Synonyms:
2-(tert-butylamino)-1-[7-(1-hydroxyethyl)-1-benzofuran-2-yl]ethanol;
Categories:
Organic Chemistry > Amides

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1'-Hydroxy Bufuralol Basic Attributes

Molecular Weight：

277.35900

Exact Mass：

277.16779360 g/mol

Characteristics

PSA：

65.63000

XLogP3：

3.29850

Density：

1.139g/cm3

Melting Point：

41-49ºC

Boiling Point：

433ºC at 760mmHg

Flash Point：

215.7ºC

Refractive Index：

1.577

Storage Conditions：

-20ºC Freezer

Safety Information

GHS Classification：

|Warning|H302 (100%): Harmful if swallowed [Warning Acute toxicity, oral]|P264, P270, P301+P312, P330, and P501|The GHS information provided by 1 company from 1 notification to the ECHA C&L Inventory.

Drug Information

MeSH Entry Terms：

1'-hydroxybufuralol

Computed Properties

Molecular Weight:277.36
XLogP3:2.2
Hydrogen Bond Donor Count:3
Hydrogen Bond Acceptor Count:4
Rotatable Bond Count:5
Exact Mass:277.16779360
Monoisotopic Mass:277.16779360
Topological Polar Surface Area:65.6
Heavy Atom Count:20
Complexity:315
Undefined Atom Stereocenter Count:2
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes