1,3-Propanediol, 2-(chloromethyl)-2-((2-naphthyloxy)methyl)-
2-(chloromethyl)-2-(naphthalen-2-yloxymethyl)propane-1,3-diol
Molecular Identity
1,3-Propanediol, 2-(chloromethyl)-2-((2-naphthyloxy)methyl)-
2-(chloromethyl)-2-(naphthalen-2-yloxymethyl)propane-1,3-diol
PubChem CID: 120393
2D Structure
Properties
C15H17ClO3
Molecular Formula
280.74
Molecular Weight
g/mol
280.0866
Exact Mass
Da
2.8
XLogP
Drug-like (Lipinski: < 5)
49.7
TPSA
Good oral absorption (< 140 A²)
2
H-Bond Donors
3
H-Bond Acceptors
268
Complexity
SMILES
Canonical SMILES
SMILES: C1=CC=C2C=C(C=CC2=C1)OCC(CO)(CO)CClIsomeric SMILES
SMILES: C1=CC=C2C=C(C=CC2=C1)OCC(CO)(CO)CClSynonyms(20)
2-(Chloromethyl)-2-((2-naphthyloxy)methyl)-1,3-propanediol842-91-1HC 1532BRN 25300901,3-Propanediol, 2-(chloromethyl)-2-((2-naphthyloxy)methyl)-Chloromethyl-2 beta-naphthyloxymethyl-2 propanediol-1,3 [French]1,3-Propanediol, 2-(chloromethyl)-2-((2-naphthalenyloxy)methyl)-Chloromethyl-2 beta-naphthyloxymethyl-2 propanediol-1,3RefChem:2196032-(chloromethyl)-2-[(naphthalen-2-yloxy)methyl]propane-1,3-diol2-(chloromethyl)-2-(naphthalen-2-yloxymethyl)propane-1,3-diolCarbomer 9802-(chloromethyl)-2-((naphthalen-2-yloxy)methyl)propane-1,3-diolorb2663932DTXSID60864160
Data from PubChem (NCBI)
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Molecular Structure
1,3-Propanediol, 2-(chloromethyl)-2-((2-naphthyloxy)methyl)-
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Drug Network
Trials and conditions connected to 1,3-Propanediol, 2-(chloromethyl)-2-((2-naphthyloxy)methyl)-
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