3-[(1S)-1-deuterio-1-hydroxy-2-(trideuteriomethylamino)ethyl]phenol;3-[(1R)-1-deuterio-1-hydroxy-2-(trideuteriomethylamino)ethyl]phenol;3-[(1R)-2,2-dideuterio-1-hydroxy-2-(trideuteriomethylamino)ethyl]phenol;3-[(1S)-2,2-dideuterio-1-hydroxy-2-(trideuteriomethylamino)ethyl]phenol;3-[(1R)-1-hydroxy-2-(trideuteriomethylamino)ethyl]phenol;3-[(1S)-1-hydroxy-2-(trideuteriomethylamino)ethyl]phenol;2,3,4,6-tetradeuterio-5-[1-deuterio-1-hydroxy-2-(trideuteriomethylamino)ethyl]phenol;2,3,4,6-tetradeuterio-5-[1-hydroxy-2-(trideuteriomethylamino)ethyl]phenol;3-[(1S)-1,2,2-trideuterio-1-hydroxy-2-(trideuteriomethylamino)ethyl]phenol;3-[(1R)-1,2,2-trideuterio-1-hydroxy-2-(trideuteriomethylamino)ethyl]phenol;3-[1,2,2-trideuterio-1-hydroxy-2-(trideuteriomethylamino)ethyl]phenol

C99H143N11O22 — CID 159595193

IUPAC3-[(1S)-1-deuterio-1-hydroxy-2-(trideuteriomethylamino)ethyl]phenol;3-[(1R)-1-deuterio-1-hydroxy-2-(trideuteriomethylamino)ethyl]phenol;3-[(1R)-2,2-dideuterio-1-hydroxy-2-(trideuteriomethylamino)ethyl]phenol;3-[(1S)-2,2-dideuterio-1-hydroxy-2-(trideuteriomethylamino)ethyl]phenol;3-[(1R)-1-hydroxy-2-(trideuteriomethylamino)ethyl]phenol;3-[(1S)-1-hydroxy-2-(trideuteriomethylamino)ethyl]phenol;2,3,4,6-tetradeuterio-5-[1-deuterio-1-hydroxy-2-(trideuteriomethylamino)ethyl]phenol;2,3,4,6-tetradeuterio-5-[1-hydroxy-2-(trideuteriomethylamino)ethyl]phenol;3-[(1S)-1,2,2-trideuterio-1-hydroxy-2-(trideuteriomethylamino)ethyl]phenol;3-[(1R)-1,2,2-trideuterio-1-hydroxy-2-(trideuteriomethylamino)ethyl]phenol;3-[1,2,2-trideuterio-1-hydroxy-2-(trideuteriomethylamino)ethyl]phenol
SMILES[2H]C([2H])([2H])NC([2H])([2H])C([2H])(O)c1cccc(O)c1.[2H]C([2H])([2H])NC([2H])([2H])[C@@H](O)c1cccc(O)c1.[2H]C([2H])([2H])NC([2H])([2H])[C@@]([2H])(O)c1cccc(O)c1.[2H]C([2H])([2H])NC([2H])([2H])[C@H](O)c1cccc(O)c1.[2H]C([2H])([2H])NC([2H])([2H])[C@]([2H])(O)c1cccc(O)c1.[2H]C([2H])([2H])NC[C@@H](O)c1cccc(O)c1.[2H]C([2H])([2H])NC[C@@]([2H])(O)c1cccc(O)c1.[2H]C([2H])([2H])NC[C@H](O)c1cccc(O)c1.[2H]C([2H])([2H])NC[C@]([2H])(O)c1cccc(O)c1.[2H]c1c([2H])c(O)c([2H])c(C(O)CNC([2H])([2H])[2H])c1[2H].[2H]c1c([2H])c(O)c([2H])c(C([2H])(O)CNC([2H])([2H])[2H])c1[2H]
InChIInChI=1S/11C9H13NO2/c11*1-10-6-9(12)7-3-2-4-8(11)5-7/h11*2-5,9-12H,6H2,1H3/t8*9-;;;/m11110000.../s1/i1D3,6D2,9D;1D3,9D;1D3,6D2;1D3;1D3,6D2,9D;1D3,9D;1D3,6D2;1D3;1D3,2D,3D,4D,5D,9D;1D3,2D,3D,4D,5D;1D3,6D2,9D
InChIKeyMKTBGXSONBVGTG-BFOVYDITSA-N
MW1896.64 g/mol
LogP7.09
Rot. Bonds44

About 3-[(1S)-1-deuterio-1-hydroxy-2-(trideuteriomethylamino)ethyl]phenol;3-[(1R)-1-deuterio-1-hydroxy-2-(trideuteriomethylamino)ethyl]phenol;3-[(1R)-2,2-dideuterio-1-hydroxy-2-(trideuteriomethylamino)ethyl]phenol;3-[(1S)-2,2-dideuterio-1-hydroxy-2-(trideuteriomethylamino)ethyl]phenol;3-[(1R)-1-hydroxy-2-(trideuteriomethylamino)ethyl]phenol;3-[(1S)-1-hydroxy-2-(trideuteriomethylamino)ethyl]phenol;2,3,4,6-tetradeuterio-5-[1-deuterio-1-hydroxy-2-(trideuteriomethylamino)ethyl]phenol;2,3,4,6-tetradeuterio-5-[1-hydroxy-2-(trideuteriomethylamino)ethyl]phenol;3-[(1S)-1,2,2-trideuterio-1-hydroxy-2-(trideuteriomethylamino)ethyl]phenol;3-[(1R)-1,2,2-trideuterio-1-hydroxy-2-(trideuteriomethylamino)ethyl]phenol;3-[1,2,2-trideuterio-1-hydroxy-2-(trideuteriomethylamino)ethyl]phenol

3-[(1S)-1-deuterio-1-hydroxy-2-(trideuteriomethylamino)ethyl]phenol;3-[(1R)-1-deuterio-1-hydroxy-2-(trideuteriomethylamino)ethyl]phenol;3-[(1R)-2,2-dideuterio-1-hydroxy-2-(trideuteriomethylamino)ethyl]phenol;3-[(1S)-2,2-dideuterio-1-hydroxy-2-(trideuteriomethylamino)ethyl]phenol;3-[(1R)-1-hydroxy-2-(trideuteriomethylamino)ethyl]phenol;3-[(1S)-1-hydroxy-2-(trideuteriomethylamino)ethyl]phenol;2,3,4,6-tetradeuterio-5-[1-deuterio-1-hydroxy-2-(trideuteriomethylamino)ethyl]phenol;2,3,4,6-tetradeuterio-5-[1-hydroxy-2-(trideuteriomethylamino)ethyl]phenol;3-[(1S)-1,2,2-trideuterio-1-hydroxy-2-(trideuteriomethylamino)ethyl]phenol;3-[(1R)-1,2,2-trideuterio-1-hydroxy-2-(trideuteriomethylamino)ethyl]phenol;3-[1,2,2-trideuterio-1-hydroxy-2-(trideuteriomethylamino)ethyl]phenol (PubChem CID 159595193) has the molecular formula C99H143N11O22 and a molecular weight of 1896.64 g/mol. Its IUPAC name is 3-[(1S)-1-deuterio-1-hydroxy-2-(trideuteriomethylamino)ethyl]phenol;3-[(1R)-1-deuterio-1-hydroxy-2-(trideuteriomethylamino)ethyl]phenol;3-[(1R)-2,2-dideuterio-1-hydroxy-2-(trideuteriomethylamino)ethyl]phenol;3-[(1S)-2,2-dideuterio-1-hydroxy-2-(trideuteriomethylamino)ethyl]phenol;3-[(1R)-1-hydroxy-2-(trideuteriomethylamino)ethyl]phenol;3-[(1S)-1-hydroxy-2-(trideuteriomethylamino)ethyl]phenol;2,3,4,6-tetradeuterio-5-[1-deuterio-1-hydroxy-2-(trideuteriomethylamino)ethyl]phenol;2,3,4,6-tetradeuterio-5-[1-hydroxy-2-(trideuteriomethylamino)ethyl]phenol;3-[(1S)-1,2,2-trideuterio-1-hydroxy-2-(trideuteriomethylamino)ethyl]phenol;3-[(1R)-1,2,2-trideuterio-1-hydroxy-2-(trideuteriomethylamino)ethyl]phenol;3-[1,2,2-trideuterio-1-hydroxy-2-(trideuteriomethylamino)ethyl]phenol.

Molecular Properties

Compound Name3-[(1S)-1-deuterio-1-hydroxy-2-(trideuteriomethylamino)ethyl]phenol;3-[(1R)-1-deuterio-1-hydroxy-2-(trideuteriomethylamino)ethyl]phenol;3-[(1R)-2,2-dideuterio-1-hydroxy-2-(trideuteriomethylamino)ethyl]phenol;3-[(1S)-2,2-dideuterio-1-hydroxy-2-(trideuteriomethylamino)ethyl]phenol;3-[(1R)-1-hydroxy-2-(trideuteriomethylamino)ethyl]phenol;3-[(1S)-1-hydroxy-2-(trideuteriomethylamino)ethyl]phenol;2,3,4,6-tetradeuterio-5-[1-deuterio-1-hydroxy-2-(trideuteriomethylamino)ethyl]phenol;2,3,4,6-tetradeuterio-5-[1-hydroxy-2-(trideuteriomethylamino)ethyl]phenol;3-[(1S)-1,2,2-trideuterio-1-hydroxy-2-(trideuteriomethylamino)ethyl]phenol;3-[(1R)-1,2,2-trideuterio-1-hydroxy-2-(trideuteriomethylamino)ethyl]phenol;3-[1,2,2-trideuterio-1-hydroxy-2-(trideuteriomethylamino)ethyl]phenol
PubChem CID159595193
Molecular FormulaC99H143N11O22
Molecular Weight1896.64 g/mol
Exact Mass1895.40
IUPAC Name3-[(1S)-1-deuterio-1-hydroxy-2-(trideuteriomethylamino)ethyl]phenol;3-[(1R)-1-deuterio-1-hydroxy-2-(trideuteriomethylamino)ethyl]phenol;3-[(1R)-2,2-dideuterio-1-hydroxy-2-(trideuteriomethylamino)ethyl]phenol;3-[(1S)-2,2-dideuterio-1-hydroxy-2-(trideuteriomethylamino)ethyl]phenol;3-[(1R)-1-hydroxy-2-(trideuteriomethylamino)ethyl]phenol;3-[(1S)-1-hydroxy-2-(trideuteriomethylamino)ethyl]phenol;2,3,4,6-tetradeuterio-5-[1-deuterio-1-hydroxy-2-(trideuteriomethylamino)ethyl]phenol;2,3,4,6-tetradeuterio-5-[1-hydroxy-2-(trideuteriomethylamino)ethyl]phenol;3-[(1S)-1,2,2-trideuterio-1-hydroxy-2-(trideuteriomethylamino)ethyl]phenol;3-[(1R)-1,2,2-trideuterio-1-hydroxy-2-(trideuteriomethylamino)ethyl]phenol;3-[1,2,2-trideuterio-1-hydroxy-2-(trideuteriomethylamino)ethyl]phenol
SMILES[2H]C([2H])([2H])NC([2H])([2H])C([2H])(O)c1cccc(O)c1.[2H]C([2H])([2H])NC([2H])([2H])[C@@H](O)c1cccc(O)c1.[2H]C([2H])([2H])NC([2H])([2H])[C@@]([2H])(O)c1cccc(O)c1.[2H]C([2H])([2H])NC([2H])([2H])[C@H](O)c1cccc(O)c1.[2H]C([2H])([2H])NC([2H])([2H])[C@]([2H])(O)c1cccc(O)c1.[2H]C([2H])([2H])NC[C@@H](O)c1cccc(O)c1.[2H]C([2H])([2H])NC[C@@]([2H])(O)c1cccc(O)c1.[2H]C([2H])([2H])NC[C@H](O)c1cccc(O)c1.[2H]C([2H])([2H])NC[C@]([2H])(O)c1cccc(O)c1.[2H]c1c([2H])c(O)c([2H])c(C(O)CNC([2H])([2H])[2H])c1[2H].[2H]c1c([2H])c(O)c([2H])c(C([2H])(O)CNC([2H])([2H])[2H])c1[2H]
InChIInChI=1S/11C9H13NO2/c11*1-10-6-9(12)7-3-2-4-8(11)5-7/h11*2-5,9-12H,6H2,1H3/t8*9-;;;/m11110000.../s1/i1D3,6D2,9D;1D3,9D;1D3,6D2;1D3;1D3,6D2,9D;1D3,9D;1D3,6D2;1D3;1D3,2D,3D,4D,5D,9D;1D3,2D,3D,4D,5D;1D3,6D2,9D
InChIKeyMKTBGXSONBVGTG-BFOVYDITSA-N
XLogP7.09
TPSA577.39 Ų
H-Bond Donors33
H-Bond Acceptors33
Rotatable Bonds44
Heavy Atoms132
Complexity—

Lipinski Rule of Five

4 violations

RuleValue
MW ≤ 5001896.64
LogP ≤ 57.09
H-Bond Donors ≤ 533
H-Bond Acceptors ≤ 1033

Analyze 3-[(1S)-1-deuterio-1-hydroxy-2-(trideuteriomethylamino)ethyl]phenol;3-[(1R)-1-deuterio-1-hydroxy-2-(trideuteriomethylamino)ethyl]phenol;3-[(1R)-2,2-dideuterio-1-hydroxy-2-(trideuteriomethylamino)ethyl]phenol;3-[(1S)-2,2-dideuterio-1-hydroxy-2-(trideuteriomethylamino)ethyl]phenol;3-[(1R)-1-hydroxy-2-(trideuteriomethylamino)ethyl]phenol;3-[(1S)-1-hydroxy-2-(trideuteriomethylamino)ethyl]phenol;2,3,4,6-tetradeuterio-5-[1-deuterio-1-hydroxy-2-(trideuteriomethylamino)ethyl]phenol;2,3,4,6-tetradeuterio-5-[1-hydroxy-2-(trideuteriomethylamino)ethyl]phenol;3-[(1S)-1,2,2-trideuterio-1-hydroxy-2-(trideuteriomethylamino)ethyl]phenol;3-[(1R)-1,2,2-trideuterio-1-hydroxy-2-(trideuteriomethylamino)ethyl]phenol;3-[1,2,2-trideuterio-1-hydroxy-2-(trideuteriomethylamino)ethyl]phenol with MolForge

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Related Compounds

2,3,4,6-tetradeuterio-5-[(1R)-2,2-dideuterio-1-hydroxy-2-(trideuteriomethylamino)ethyl]phenol
CID 25177762
3-[(1R)-1-deuterio-1-hydroxy-2-(trideuteriomethylamino)ethyl]phenol
CID 25177202
3-[(1R)-1-hydroxy-2-(trideuterio(113C)methylamino)ethyl]phenol
CID 76973806
3-[(1R)-1-deuterio-1-hydroxy-2-(methylamino)ethyl]phenol
CID 59348047
3-[(1S)-1-hydroxy-2-(methylamino)ethyl]phenol;hydrochloride
CID 16745125
2,2-dideuterio-1-[3-(methoxymethoxy)phenyl]-2-(trideuteriomethylamino)ethanol
CID 59348055
(Z)-but-2-enedioic acid;3-[1-hydroxy-2-(methylamino)ethyl]phenol
CID 68717826
(2S)-N,1,1,2-tetradeuterio-2-deuteriooxy-2-(3-deuteriooxyphenyl)-N-(trideuteriomethyl)ethanamine
CID 25177277
3-[(1S)-2-[(4,6-dimethylpyrimidin-2-yl)amino]-1-hydroxyethyl]phenol
CID 7435960
[2-hydroxy-2-(3-hydroxyphenyl)ethyl]carbamic acid
CID 70112963
N-[2-hydroxy-2-(3-hydroxyphenyl)ethyl]propanamide
CID 20616558
N-(2,6-dichlorophenyl)-4,5-dihydro-1H-imidazol-2-amine;3-[(1R)-1-hydroxy-2-(methylamino)ethyl]phenol
CID 53495159

Frequently Asked Questions

What is the IUPAC name of 3-[(1S)-1-deuterio-1-hydroxy-2-(trideuteriomethylamino)ethyl]phenol;3-[(1R)-1-deuterio-1-hydroxy-2-(trideuteriomethylamino)ethyl]phenol;3-[(1R)-2,2-dideuterio-1-hydroxy-2-(trideuteriomethylamino)ethyl]phenol;3-[(1S)-2,2-dideuterio-1-hydroxy-2-(trideuteriomethylamino)ethyl]phenol;3-[(1R)-1-hydroxy-2-(trideuteriomethylamino)ethyl]phenol;3-[(1S)-1-hydroxy-2-(trideuteriomethylamino)ethyl]phenol;2,3,4,6-tetradeuterio-5-[1-deuterio-1-hydroxy-2-(trideuteriomethylamino)ethyl]phenol;2,3,4,6-tetradeuterio-5-[1-hydroxy-2-(trideuteriomethylamino)ethyl]phenol;3-[(1S)-1,2,2-trideuterio-1-hydroxy-2-(trideuteriomethylamino)ethyl]phenol;3-[(1R)-1,2,2-trideuterio-1-hydroxy-2-(trideuteriomethylamino)ethyl]phenol;3-[1,2,2-trideuterio-1-hydroxy-2-(trideuteriomethylamino)ethyl]phenol?
The IUPAC name of 3-[(1S)-1-deuterio-1-hydroxy-2-(trideuteriomethylamino)ethyl]phenol;3-[(1R)-1-deuterio-1-hydroxy-2-(trideuteriomethylamino)ethyl]phenol;3-[(1R)-2,2-dideuterio-1-hydroxy-2-(trideuteriomethylamino)ethyl]phenol;3-[(1S)-2,2-dideuterio-1-hydroxy-2-(trideuteriomethylamino)ethyl]phenol;3-[(1R)-1-hydroxy-2-(trideuteriomethylamino)ethyl]phenol;3-[(1S)-1-hydroxy-2-(trideuteriomethylamino)ethyl]phenol;2,3,4,6-tetradeuterio-5-[1-deuterio-1-hydroxy-2-(trideuteriomethylamino)ethyl]phenol;2,3,4,6-tetradeuterio-5-[1-hydroxy-2-(trideuteriomethylamino)ethyl]phenol;3-[(1S)-1,2,2-trideuterio-1-hydroxy-2-(trideuteriomethylamino)ethyl]phenol;3-[(1R)-1,2,2-trideuterio-1-hydroxy-2-(trideuteriomethylamino)ethyl]phenol;3-[1,2,2-trideuterio-1-hydroxy-2-(trideuteriomethylamino)ethyl]phenol (CID 159595193) is 3-[(1S)-1-deuterio-1-hydroxy-2-(trideuteriomethylamino)ethyl]phenol;3-[(1R)-1-deuterio-1-hydroxy-2-(trideuteriomethylamino)ethyl]phenol;3-[(1R)-2,2-dideuterio-1-hydroxy-2-(trideuteriomethylamino)ethyl]phenol;3-[(1S)-2,2-dideuterio-1-hydroxy-2-(trideuteriomethylamino)ethyl]phenol;3-[(1R)-1-hydroxy-2-(trideuteriomethylamino)ethyl]phenol;3-[(1S)-1-hydroxy-2-(trideuteriomethylamino)ethyl]phenol;2,3,4,6-tetradeuterio-5-[1-deuterio-1-hydroxy-2-(trideuteriomethylamino)ethyl]phenol;2,3,4,6-tetradeuterio-5-[1-hydroxy-2-(trideuteriomethylamino)ethyl]phenol;3-[(1S)-1,2,2-trideuterio-1-hydroxy-2-(trideuteriomethylamino)ethyl]phenol;3-[(1R)-1,2,2-trideuterio-1-hydroxy-2-(trideuteriomethylamino)ethyl]phenol;3-[1,2,2-trideuterio-1-hydroxy-2-(trideuteriomethylamino)ethyl]phenol.
What is the SMILES notation for 3-[(1S)-1-deuterio-1-hydroxy-2-(trideuteriomethylamino)ethyl]phenol;3-[(1R)-1-deuterio-1-hydroxy-2-(trideuteriomethylamino)ethyl]phenol;3-[(1R)-2,2-dideuterio-1-hydroxy-2-(trideuteriomethylamino)ethyl]phenol;3-[(1S)-2,2-dideuterio-1-hydroxy-2-(trideuteriomethylamino)ethyl]phenol;3-[(1R)-1-hydroxy-2-(trideuteriomethylamino)ethyl]phenol;3-[(1S)-1-hydroxy-2-(trideuteriomethylamino)ethyl]phenol;2,3,4,6-tetradeuterio-5-[1-deuterio-1-hydroxy-2-(trideuteriomethylamino)ethyl]phenol;2,3,4,6-tetradeuterio-5-[1-hydroxy-2-(trideuteriomethylamino)ethyl]phenol;3-[(1S)-1,2,2-trideuterio-1-hydroxy-2-(trideuteriomethylamino)ethyl]phenol;3-[(1R)-1,2,2-trideuterio-1-hydroxy-2-(trideuteriomethylamino)ethyl]phenol;3-[1,2,2-trideuterio-1-hydroxy-2-(trideuteriomethylamino)ethyl]phenol?
The canonical SMILES for 3-[(1S)-1-deuterio-1-hydroxy-2-(trideuteriomethylamino)ethyl]phenol;3-[(1R)-1-deuterio-1-hydroxy-2-(trideuteriomethylamino)ethyl]phenol;3-[(1R)-2,2-dideuterio-1-hydroxy-2-(trideuteriomethylamino)ethyl]phenol;3-[(1S)-2,2-dideuterio-1-hydroxy-2-(trideuteriomethylamino)ethyl]phenol;3-[(1R)-1-hydroxy-2-(trideuteriomethylamino)ethyl]phenol;3-[(1S)-1-hydroxy-2-(trideuteriomethylamino)ethyl]phenol;2,3,4,6-tetradeuterio-5-[1-deuterio-1-hydroxy-2-(trideuteriomethylamino)ethyl]phenol;2,3,4,6-tetradeuterio-5-[1-hydroxy-2-(trideuteriomethylamino)ethyl]phenol;3-[(1S)-1,2,2-trideuterio-1-hydroxy-2-(trideuteriomethylamino)ethyl]phenol;3-[(1R)-1,2,2-trideuterio-1-hydroxy-2-(trideuteriomethylamino)ethyl]phenol;3-[1,2,2-trideuterio-1-hydroxy-2-(trideuteriomethylamino)ethyl]phenol is [2H]C([2H])([2H])NC([2H])([2H])C([2H])(O)c1cccc(O)c1.[2H]C([2H])([2H])NC([2H])([2H])[C@@H](O)c1cccc(O)c1.[2H]C([2H])([2H])NC([2H])([2H])[C@@]([2H])(O)c1cccc(O)c1.[2H]C([2H])([2H])NC([2H])([2H])[C@H](O)c1cccc(O)c1.[2H]C([2H])([2H])NC([2H])([2H])[C@]([2H])(O)c1cccc(O)c1.[2H]C([2H])([2H])NC[C@@H](O)c1cccc(O)c1.[2H]C([2H])([2H])NC[C@@]([2H])(O)c1cccc(O)c1.[2H]C([2H])([2H])NC[C@H](O)c1cccc(O)c1.[2H]C([2H])([2H])NC[C@]([2H])(O)c1cccc(O)c1.[2H]c1c([2H])c(O)c([2H])c(C(O)CNC([2H])([2H])[2H])c1[2H].[2H]c1c([2H])c(O)c([2H])c(C([2H])(O)CNC([2H])([2H])[2H])c1[2H].
What is the InChIKey of 3-[(1S)-1-deuterio-1-hydroxy-2-(trideuteriomethylamino)ethyl]phenol;3-[(1R)-1-deuterio-1-hydroxy-2-(trideuteriomethylamino)ethyl]phenol;3-[(1R)-2,2-dideuterio-1-hydroxy-2-(trideuteriomethylamino)ethyl]phenol;3-[(1S)-2,2-dideuterio-1-hydroxy-2-(trideuteriomethylamino)ethyl]phenol;3-[(1R)-1-hydroxy-2-(trideuteriomethylamino)ethyl]phenol;3-[(1S)-1-hydroxy-2-(trideuteriomethylamino)ethyl]phenol;2,3,4,6-tetradeuterio-5-[1-deuterio-1-hydroxy-2-(trideuteriomethylamino)ethyl]phenol;2,3,4,6-tetradeuterio-5-[1-hydroxy-2-(trideuteriomethylamino)ethyl]phenol;3-[(1S)-1,2,2-trideuterio-1-hydroxy-2-(trideuteriomethylamino)ethyl]phenol;3-[(1R)-1,2,2-trideuterio-1-hydroxy-2-(trideuteriomethylamino)ethyl]phenol;3-[1,2,2-trideuterio-1-hydroxy-2-(trideuteriomethylamino)ethyl]phenol?
The InChIKey is MKTBGXSONBVGTG-BFOVYDITSA-N. The full InChI is InChI=1S/11C9H13NO2/c11*1-10-6-9(12)7-3-2-4-8(11)5-7/h11*2-5,9-12H,6H2,1H3/t8*9-;;;/m11110000.../s1/i1D3,6D2,9D;1D3,9D;1D3,6D2;1D3;1D3,6D2,9D;1D3,9D;1D3,6D2;1D3;1D3,2D,3D,4D,5D,9D;1D3,2D,3D,4D,5D;1D3,6D2,9D.
What are the key properties of 3-[(1S)-1-deuterio-1-hydroxy-2-(trideuteriomethylamino)ethyl]phenol;3-[(1R)-1-deuterio-1-hydroxy-2-(trideuteriomethylamino)ethyl]phenol;3-[(1R)-2,2-dideuterio-1-hydroxy-2-(trideuteriomethylamino)ethyl]phenol;3-[(1S)-2,2-dideuterio-1-hydroxy-2-(trideuteriomethylamino)ethyl]phenol;3-[(1R)-1-hydroxy-2-(trideuteriomethylamino)ethyl]phenol;3-[(1S)-1-hydroxy-2-(trideuteriomethylamino)ethyl]phenol;2,3,4,6-tetradeuterio-5-[1-deuterio-1-hydroxy-2-(trideuteriomethylamino)ethyl]phenol;2,3,4,6-tetradeuterio-5-[1-hydroxy-2-(trideuteriomethylamino)ethyl]phenol;3-[(1S)-1,2,2-trideuterio-1-hydroxy-2-(trideuteriomethylamino)ethyl]phenol;3-[(1R)-1,2,2-trideuterio-1-hydroxy-2-(trideuteriomethylamino)ethyl]phenol;3-[1,2,2-trideuterio-1-hydroxy-2-(trideuteriomethylamino)ethyl]phenol?
3-[(1S)-1-deuterio-1-hydroxy-2-(trideuteriomethylamino)ethyl]phenol;3-[(1R)-1-deuterio-1-hydroxy-2-(trideuteriomethylamino)ethyl]phenol;3-[(1R)-2,2-dideuterio-1-hydroxy-2-(trideuteriomethylamino)ethyl]phenol;3-[(1S)-2,2-dideuterio-1-hydroxy-2-(trideuteriomethylamino)ethyl]phenol;3-[(1R)-1-hydroxy-2-(trideuteriomethylamino)ethyl]phenol;3-[(1S)-1-hydroxy-2-(trideuteriomethylamino)ethyl]phenol;2,3,4,6-tetradeuterio-5-[1-deuterio-1-hydroxy-2-(trideuteriomethylamino)ethyl]phenol;2,3,4,6-tetradeuterio-5-[1-hydroxy-2-(trideuteriomethylamino)ethyl]phenol;3-[(1S)-1,2,2-trideuterio-1-hydroxy-2-(trideuteriomethylamino)ethyl]phenol;3-[(1R)-1,2,2-trideuterio-1-hydroxy-2-(trideuteriomethylamino)ethyl]phenol;3-[1,2,2-trideuterio-1-hydroxy-2-(trideuteriomethylamino)ethyl]phenol has a molecular weight of 1896.64 g/mol, XLogP of 7.09, 44 rotatable bonds, 33 hydrogen bond donors, and 33 hydrogen bond acceptors.
Where does this data come from?
All data for 3-[(1S)-1-deuterio-1-hydroxy-2-(trideuteriomethylamino)ethyl]phenol;3-[(1R)-1-deuterio-1-hydroxy-2-(trideuteriomethylamino)ethyl]phenol;3-[(1R)-2,2-dideuterio-1-hydroxy-2-(trideuteriomethylamino)ethyl]phenol;3-[(1S)-2,2-dideuterio-1-hydroxy-2-(trideuteriomethylamino)ethyl]phenol;3-[(1R)-1-hydroxy-2-(trideuteriomethylamino)ethyl]phenol;3-[(1S)-1-hydroxy-2-(trideuteriomethylamino)ethyl]phenol;2,3,4,6-tetradeuterio-5-[1-deuterio-1-hydroxy-2-(trideuteriomethylamino)ethyl]phenol;2,3,4,6-tetradeuterio-5-[1-hydroxy-2-(trideuteriomethylamino)ethyl]phenol;3-[(1S)-1,2,2-trideuterio-1-hydroxy-2-(trideuteriomethylamino)ethyl]phenol;3-[(1R)-1,2,2-trideuterio-1-hydroxy-2-(trideuteriomethylamino)ethyl]phenol;3-[1,2,2-trideuterio-1-hydroxy-2-(trideuteriomethylamino)ethyl]phenol is sourced from PubChem (CID 159595193), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).