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

Base Information

• Chemical Name: 2-(Hydroxymethyl)-2-(octylamino)propane-1,3-diol
• CAS No.: 100543-12-2
• Molecular Formula: C12H27NO3
• DSSTox Substance ID: DTXSID80365684
• Wikidata: Q82150555
• ChEMBL ID: CHEMBL1504499
• Mol file: 100543-12-2.mol

Synonyms:2-(hydroxymethyl)-2-(octylamino)propane-1,3-diol;100543-12-2;MLS001029790;CHEMBL1504499;SCHEMBL12858918;DTXSID80365684;HMS2777M18;STK448074;AKOS003242289;SMR000427175;2-Hydroxymethyl-2-octylamino-propane-1,3-diol;2-(hydroxymethyl)-2-(octylamino)-1,3-propanediol

Chemical Property of 2-(Hydroxymethyl)-2-(octylamino)propane-1,3-diol

Chemical Property:

• XLogP3: 1
• Hydrogen Bond Donor Count: 4
• Hydrogen Bond Acceptor Count: 4
• Rotatable Bond Count: 11
• Exact Mass: 233.19909372
• Heavy Atom Count: 16
• Complexity: 141

Purity/Quality:

Safty Information:

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MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CCCCCCCCNC(CO)(CO)CO

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