[5-[2-[2-(3,4-dimethoxyphenyl)ethylsilyloxy-dimethylsilyl]ethyl]-2-methoxyphenyl]methanol

C22H34O5Si2 — CID 161479494

IUPAC[5-[2-[2-(3,4-dimethoxyphenyl)ethylsilyloxy-dimethylsilyl]ethyl]-2-methoxyphenyl]methanol
SMILESCOc1ccc(CC[Si](C)(C)O[SiH2]CCc2ccc(OC)c(OC)c2)cc1CO
InChIInChI=1S/C22H34O5Si2/c1-24-20-8-6-18(14-19(20)16-23)11-13-29(4,5)27-28-12-10-17-7-9-21(25-2)22(15-17)26-3/h6-9,14-15,23H,10-13,16,28H2,1-5H3
InChIKeyGEFISVROUWLAJK-UHFFFAOYSA-N
MW434.68 g/mol
LogP3.71
Rot. Bonds12

About [5-[2-[2-(3,4-dimethoxyphenyl)ethylsilyloxy-dimethylsilyl]ethyl]-2-methoxyphenyl]methanol

[5-[2-[2-(3,4-dimethoxyphenyl)ethylsilyloxy-dimethylsilyl]ethyl]-2-methoxyphenyl]methanol (PubChem CID 161479494) has the molecular formula C22H34O5Si2 and a molecular weight of 434.68 g/mol. Its IUPAC name is [5-[2-[2-(3,4-dimethoxyphenyl)ethylsilyloxy-dimethylsilyl]ethyl]-2-methoxyphenyl]methanol.

Molecular Properties

Compound Name[5-[2-[2-(3,4-dimethoxyphenyl)ethylsilyloxy-dimethylsilyl]ethyl]-2-methoxyphenyl]methanol
PubChem CID161479494
Molecular FormulaC22H34O5Si2
Molecular Weight434.68 g/mol
Exact Mass434.19
IUPAC Name[5-[2-[2-(3,4-dimethoxyphenyl)ethylsilyloxy-dimethylsilyl]ethyl]-2-methoxyphenyl]methanol
SMILESCOc1ccc(CC[Si](C)(C)O[SiH2]CCc2ccc(OC)c(OC)c2)cc1CO
InChIInChI=1S/C22H34O5Si2/c1-24-20-8-6-18(14-19(20)16-23)11-13-29(4,5)27-28-12-10-17-7-9-21(25-2)22(15-17)26-3/h6-9,14-15,23H,10-13,16,28H2,1-5H3
InChIKeyGEFISVROUWLAJK-UHFFFAOYSA-N
XLogP3.71
TPSA57.15 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds12
Heavy Atoms29
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500434.68
LogP ≤ 53.71
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

Computed Properties (RDKit)

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

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Related Compounds

[5-[2-[[2-(3,4-dimethoxyphenyl)ethyl-dimethylsilyl]oxy-dimethylsilyl]ethyl]-2-methoxyphenyl]methanol
CID 160591805
1-(2-chloro-4-methoxy-3,5-dimethylphenyl)-4-methoxy-2,3,5-trimethylbenzene;[5-[2-[2-(3,4-dimethoxyphenyl)ethylsilyloxy-dimethylsilyl]ethyl]-2-methoxyphenyl]methanol;2-methoxy-5-(4-methoxy-3,5-dimethylphenyl)-1,3-dimethylbenzene;2-methoxy-5-[2-(4-methoxy-3,5-dimethylphenyl)propan-2-yl]-1,3-dimethylbenzene
CID 161479492
[5-[3-[[3-(3-methoxy-4-propan-2-yloxyphenyl)propyl-dimethylsilyl]oxy-dimethylsilyl]propyl]-2-propan-2-yloxyphenyl]methanol
CID 140768575
[3-(hydroxymethyl)-4-methoxyphenyl]methylboronic acid
CID 174806441
4-[3-[[3-(4-hydroxy-3-methoxyphenyl)propyl-dimethylsilyl]oxy-dimethylsilyl]propyl]-2-(hydroxymethyl)phenol
CID 59163577
4-[3-[[[[[[[[[[[[[[[[[[[[[[[[[[[[[[[[[[[[[[[3-(4-hydroxy-3-methoxyphenyl)propyl-dimethylsilyl]oxy-dimethylsilyl]oxy-dimethylsilyl]oxy-dimethylsilyl]oxy-dimethylsilyl]oxy-dimethylsilyl]oxy-dimethylsilyl]oxy-dimethylsilyl]oxy-dimethylsilyl]oxy-dimethylsilyl]oxy-dimethylsilyl]oxy-dimethylsilyl]oxy-dimethylsilyl]oxy-dimethylsilyl]oxy-dimethylsilyl]oxy-dimethylsilyl]oxy-dimethylsilyl]oxy-dimethylsilyl]oxy-dimethylsilyl]oxy-dimethylsilyl]oxy-dimethylsilyl]oxy-dimethylsilyl]oxy-dimethylsilyl]oxy-dimethylsilyl]oxy-dimethylsilyl]oxy-dimethylsilyl]oxy-dimethylsilyl]oxy-dimethylsilyl]oxy-dimethylsilyl]oxy-dimethylsilyl]oxy-dimethylsilyl]oxy-dimethylsilyl]oxy-dimethylsilyl]oxy-dimethylsilyl]oxy-dimethylsilyl]oxy-dimethylsilyl]oxy-dimethylsilyl]oxy-dimethylsilyl]oxy-dimethylsilyl]propyl]-2-(hydroxymethyl)phenol
CID 167345070
4-[3-[[3-(4-hydroxy-3-methoxyphenyl)propyl-dimethylsilyl]oxy-dimethylsilyl]propyl]-2-(hydroxymethyl)phenol;2-[3-[[3-(2-hydroxyphenyl)propyl-dimethylsilyl]oxy-dimethylsilyl]propyl]phenol;methane
CID 157275960
2-(3,4-dimethoxyphenyl)ethoxy-trimethylsilane
CID 121004210
methyl 4-(3,4-dimethoxyphenyl)-2-oxobutanoate
CID 18370867
2-(3,4-dimethoxyphenyl)ethyl-(3-hydroxypropyl)carbamic acid
CID 69147976
methyl 3-(3,4-dimethoxyphenyl)propanimidate
CID 95445563
dichloro-[2-(3,4-dimethoxyphenyl)ethyl]-phenylsilane
CID 139667876

Frequently Asked Questions

What is the IUPAC name of [5-[2-[2-(3,4-dimethoxyphenyl)ethylsilyloxy-dimethylsilyl]ethyl]-2-methoxyphenyl]methanol?
The IUPAC name of [5-[2-[2-(3,4-dimethoxyphenyl)ethylsilyloxy-dimethylsilyl]ethyl]-2-methoxyphenyl]methanol (CID 161479494) is [5-[2-[2-(3,4-dimethoxyphenyl)ethylsilyloxy-dimethylsilyl]ethyl]-2-methoxyphenyl]methanol.
What is the SMILES notation for [5-[2-[2-(3,4-dimethoxyphenyl)ethylsilyloxy-dimethylsilyl]ethyl]-2-methoxyphenyl]methanol?
The canonical SMILES for [5-[2-[2-(3,4-dimethoxyphenyl)ethylsilyloxy-dimethylsilyl]ethyl]-2-methoxyphenyl]methanol is COc1ccc(CC[Si](C)(C)O[SiH2]CCc2ccc(OC)c(OC)c2)cc1CO.
What is the InChIKey of [5-[2-[2-(3,4-dimethoxyphenyl)ethylsilyloxy-dimethylsilyl]ethyl]-2-methoxyphenyl]methanol?
The InChIKey is GEFISVROUWLAJK-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H34O5Si2/c1-24-20-8-6-18(14-19(20)16-23)11-13-29(4,5)27-28-12-10-17-7-9-21(25-2)22(15-17)26-3/h6-9,14-15,23H,10-13,16,28H2,1-5H3.
What are the key properties of [5-[2-[2-(3,4-dimethoxyphenyl)ethylsilyloxy-dimethylsilyl]ethyl]-2-methoxyphenyl]methanol?
[5-[2-[2-(3,4-dimethoxyphenyl)ethylsilyloxy-dimethylsilyl]ethyl]-2-methoxyphenyl]methanol has a molecular weight of 434.68 g/mol, XLogP of 3.71, 12 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for [5-[2-[2-(3,4-dimethoxyphenyl)ethylsilyloxy-dimethylsilyl]ethyl]-2-methoxyphenyl]methanol is sourced from PubChem (CID 161479494), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).