(2R,3R,4R,5R)-1,6-bis[[tert-butyl(dimethyl)silyl]oxy]hexane-2,3,4,5-tetrol

C18H42O6Si2 — CID 11486689

IUPAC(2R,3R,4R,5R)-1,6-bis[[tert-butyl(dimethyl)silyl]oxy]hexane-2,3,4,5-tetrol
SMILESCC(C)(C)[Si](C)(C)OC[C@@H](O)[C@@H](O)[C@H](O)[C@H](O)CO[Si](C)(C)C(C)(C)C
InChIInChI=1S/C18H42O6Si2/c1-17(2,3)25(7,8)23-11-13(19)15(21)16(22)14(20)12-24-26(9,10)18(4,5)6/h13-16,19-22H,11-12H2,1-10H3/t13-,14-,15-,16-/m1/s1
InChIKeyZIEKCKSFMRPBPQ-KLHDSHLOSA-N
MW410.70 g/mol
LogP2.47
Rot. Bonds9

About (2R,3R,4R,5R)-1,6-bis[[tert-butyl(dimethyl)silyl]oxy]hexane-2,3,4,5-tetrol

(2R,3R,4R,5R)-1,6-bis[[tert-butyl(dimethyl)silyl]oxy]hexane-2,3,4,5-tetrol (PubChem CID 11486689) has the molecular formula C18H42O6Si2 and a molecular weight of 410.70 g/mol. Its IUPAC name is (2R,3R,4R,5R)-1,6-bis[[tert-butyl(dimethyl)silyl]oxy]hexane-2,3,4,5-tetrol.

Molecular Properties

Compound Name(2R,3R,4R,5R)-1,6-bis[[tert-butyl(dimethyl)silyl]oxy]hexane-2,3,4,5-tetrol
PubChem CID11486689
Molecular FormulaC18H42O6Si2
Molecular Weight410.70 g/mol
Exact Mass410.25
IUPAC Name(2R,3R,4R,5R)-1,6-bis[[tert-butyl(dimethyl)silyl]oxy]hexane-2,3,4,5-tetrol
SMILESCC(C)(C)[Si](C)(C)OC[C@@H](O)[C@@H](O)[C@H](O)[C@H](O)CO[Si](C)(C)C(C)(C)C
InChIInChI=1S/C18H42O6Si2/c1-17(2,3)25(7,8)23-11-13(19)15(21)16(22)14(20)12-24-26(9,10)18(4,5)6/h13-16,19-22H,11-12H2,1-10H3/t13-,14-,15-,16-/m1/s1
InChIKeyZIEKCKSFMRPBPQ-KLHDSHLOSA-N
XLogP2.47
TPSA99.38 Ų
H-Bond Donors4
H-Bond Acceptors6
Rotatable Bonds9
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500410.70
LogP ≤ 52.47
H-Bond Donors ≤ 54
H-Bond Acceptors ≤ 106

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'heavy_metal', 'substructure': 'N/A'}

Analyze (2R,3R,4R,5R)-1,6-bis[[tert-butyl(dimethyl)silyl]oxy]hexane-2,3,4,5-tetrol with MolForge

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Related Compounds

1-[tert-butyl(dimethyl)silyl]oxy-3-methylbutan-2-ol
CID 14336173
1-[tert-butyl(dimethyl)silyl]oxypropan-2-ol
CID 13175134
(2S,3R)-4-[tert-butyl(dimethyl)silyl]oxy-2-iodobutane-1,3-diol
CID 102271148
(2S)-1-[tert-butyl(dimethyl)silyl]oxybutan-2-ol
CID 86606837
methyl (2R,3R)-2-bromo-4-[tert-butyl(dimethyl)silyl]oxy-3-hydroxybutanoate
CID 134934318
1-[tert-butyl(dimethyl)silyl]oxypentan-2-ol
CID 10608878
(2S,3S)-1,4-bis[[tert-butyl(dimethyl)silyl]oxy]-3-(methoxymethoxy)butan-2-ol
CID 101252863
(2R,3S)-4-[tert-butyl(dimethyl)silyl]oxy-2-prop-1-en-2-ylbutane-1,3-diol
CID 10587455
(2R,3S)-1-[tert-butyl(dimethyl)silyl]oxy-3-methoxy-5-methylhex-5-en-2-ol
CID 58797956
3-[tert-butyl(dimethyl)silyl]oxy-2,2-dimethylpropane-1,1-diol
CID 123722416
(2S)-1-[tert-butyl(dimethyl)silyl]oxybut-3-yn-2-ol
CID 20848710
(3R)-4-[tert-butyl(dimethyl)silyl]oxy-3-hydroxybutan-2-one
CID 11672982

Frequently Asked Questions

What is the IUPAC name of (2R,3R,4R,5R)-1,6-bis[[tert-butyl(dimethyl)silyl]oxy]hexane-2,3,4,5-tetrol?
The IUPAC name of (2R,3R,4R,5R)-1,6-bis[[tert-butyl(dimethyl)silyl]oxy]hexane-2,3,4,5-tetrol (CID 11486689) is (2R,3R,4R,5R)-1,6-bis[[tert-butyl(dimethyl)silyl]oxy]hexane-2,3,4,5-tetrol.
What is the SMILES notation for (2R,3R,4R,5R)-1,6-bis[[tert-butyl(dimethyl)silyl]oxy]hexane-2,3,4,5-tetrol?
The canonical SMILES for (2R,3R,4R,5R)-1,6-bis[[tert-butyl(dimethyl)silyl]oxy]hexane-2,3,4,5-tetrol is CC(C)(C)[Si](C)(C)OC[C@@H](O)[C@@H](O)[C@H](O)[C@H](O)CO[Si](C)(C)C(C)(C)C.
What is the InChIKey of (2R,3R,4R,5R)-1,6-bis[[tert-butyl(dimethyl)silyl]oxy]hexane-2,3,4,5-tetrol?
The InChIKey is ZIEKCKSFMRPBPQ-KLHDSHLOSA-N. The full InChI is InChI=1S/C18H42O6Si2/c1-17(2,3)25(7,8)23-11-13(19)15(21)16(22)14(20)12-24-26(9,10)18(4,5)6/h13-16,19-22H,11-12H2,1-10H3/t13-,14-,15-,16-/m1/s1.
What are the key properties of (2R,3R,4R,5R)-1,6-bis[[tert-butyl(dimethyl)silyl]oxy]hexane-2,3,4,5-tetrol?
(2R,3R,4R,5R)-1,6-bis[[tert-butyl(dimethyl)silyl]oxy]hexane-2,3,4,5-tetrol has a molecular weight of 410.70 g/mol, XLogP of 2.47, 9 rotatable bonds, 4 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for (2R,3R,4R,5R)-1,6-bis[[tert-butyl(dimethyl)silyl]oxy]hexane-2,3,4,5-tetrol is sourced from PubChem (CID 11486689), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).