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2-(hydroxymethyl)-2-(octylamino)propane-1,3-diol

2-(hydroxymethyl)-2-(octylamino)propane-1,3-diol structure

CAS No:
100543-12-2
Formula:
C12H27NO3
Chemical Name:
2-(hydroxymethyl)-2-(octylamino)propane-1,3-diol
Synonyms:
2-(hydroxymethyl)-2-(octylamino)propane-1,3-diol;100543-12-2;ACMC-20m3lr;MLS001029790;1,3-Propanediol, 2-(hydroxymethyl)-2-(octylamino)-;CHEMBL1504499;SCHEMBL12858918;C12H27NO3;DTXSID80365684;HMS2777M18;ZINC2322313;STK448074;AKOS003242289;MCULE-2245951989;SMR000427175;ST50908294;2-Hydroxymethyl-2-octylamino-propane-1,3-diol;2-(hydroxymethyl)-2-(octylamino)-1,3-propanediol

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2-(hydroxymethyl)-2-(octylamino)propane-1,3-diol Basic Attributes

Molecular Weight：

233.35 g/mol

Exact Mass：

233.19909372 g/mol

DSSTox ID：

DTXSID80365684

Characteristics

PSA：

72.7 Å²

Water Solubility：

29.5 [ug/mL]

Computed Properties

Molecular Weight:233.35
XLogP3:1
Hydrogen Bond Donor Count:4
Hydrogen Bond Acceptor Count:4
Rotatable Bond Count:11
Exact Mass:233.19909372
Monoisotopic Mass:233.19909372
Topological Polar Surface Area:72.7
Heavy Atom Count:16
Complexity:141
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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Guide of 2-(hydroxymethyl)-2-(octylamino)propane-1,3-diol

Basic Attributes
Characteristics
Computed Properties

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