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3-AMino-3-(hydroxyMethyl)-1-(4-octylphenyl)-1,4-butanediol

3-AMino-3-(hydroxyMethyl)-1-(4-octylphenyl)-1,4-butanediol structure

CAS No:
162361-49-1
Formula:
C19H33NO3
Chemical Name:
3-AMino-3-(hydroxyMethyl)-1-(4-octylphenyl)-1,4-butanediol
Synonyms:
3-AMino-3-(hydroxyMethyl)-1-(4-octylphenyl)-1,4-butanediol;3-amino-3-(hydroxymethyl)-1-(4-octylphenyl)butane-1,4-diol;2-amino-2-(2-hydroxy-2-(4-octylphenyl)ethyl)propane-1,3-diol;2-amino-2-[2-hydroxy-2-(4-octylphenyl)ethyl]propane-1,3-diol;SCHEMBL5847049;AKOS025401814;AC-25896;3-Amino-3-(hydroxymethyl)-1-(4-octylphenyl)butane-1,4-diol (1-Hydroxyfingolimod)

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3-AMino-3-(hydroxyMethyl)-1-(4-octylphenyl)-1,4-butanediol Basic Attributes

Molecular Weight：

323.477

Exact Mass：

323.246033

Characteristics

PSA：

86.7

XLogP3：

4.11

Density：

1.076

Boiling Point：

514.9±50.0 °C at 760 mmHg

Flash Point：

265.2±30.1 °C

Refractive Index：

1.546

Computed Properties

Molecular Weight:323.5
XLogP3:3
Hydrogen Bond Donor Count:4
Hydrogen Bond Acceptor Count:4
Rotatable Bond Count:12
Exact Mass:323.24604391
Monoisotopic Mass:323.24604391
Topological Polar Surface Area:86.7
Heavy Atom Count:23
Complexity:286
Undefined Atom Stereocenter Count:1
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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3-AMino-3-(hydroxyMethyl)-1-(4-octylphenyl)-1,4-butanediol hydrochloride

268557-51-3

Hot Searches: dinitrogen pentoxide formula; zinc carbonate; diphenylamine; acetylene formula; bromide formula; beclomethasone dipropionate

Guide of 3-AMino-3-(hydroxyMethyl)-1-(4-octylphenyl)-1,4-butanediol

Basic Attributes
Characteristics
Computed Properties
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