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4-pyrrolidin-1-yl-1-(2,4,6-trihydroxyphenyl)butan-1-one,hydrochloride

4-pyrrolidin-1-yl-1-(2,4,6-trihydroxyphenyl)butan-1-one,hydrochloride structure

CAS No:
70585-56-7
Formula:
C14H20ClNO4
Chemical Name:
4-pyrrolidin-1-yl-1-(2,4,6-trihydroxyphenyl)butan-1-one,hydrochloride
Synonyms:
1-Butanone,4-(1-pyrrolidinyl)-1-(2,4,6-trihydroxyphenyl)-,hydrochloride; 4-pyrrolidin-1-yl-1-(2,4,6-trihydroxyphenyl)butan-1-one hydrochloride;

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4-pyrrolidin-1-yl-1-(2,4,6-trihydroxyphenyl)butan-1-one,hydrochloride Basic Attributes

Molecular Weight：

301.76600

Exact Mass：

301.1080858 g/mol

DSSTox ID：

DTXSID00220867

Characteristics

PSA：

81.00000

XLogP3：

2.60200

Boiling Point：

457.6ºC at 760 mmHg

Flash Point：

230.6ºC

Drug Information

MeSH Entry Terms：

1-Butanone, 4-(1-pyrrolidinyl)-1-(2,4,6-trihydroxyphenyl)-, hydrochloride

Computed Properties

Molecular Weight:301.76
Hydrogen Bond Donor Count:4
Hydrogen Bond Acceptor Count:5
Rotatable Bond Count:5
Exact Mass:301.1080858
Monoisotopic Mass:301.1080858
Topological Polar Surface Area:81
Heavy Atom Count:20
Complexity:292
Covalently-Bonded Unit Count:2
Compound Is Canonicalized:Yes

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Guide of 4-pyrrolidin-1-yl-1-(2,4,6-trihydroxyphenyl)butan-1-one,hydrochloride

Basic Attributes
Characteristics
Drug Information
Computed Properties

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