dihydroxy-methyl-(6-phenylhexyl)silane

C13H22O2Si — CID 11586756

IUPACdihydroxy-methyl-(6-phenylhexyl)silane
SMILESC[Si](O)(O)CCCCCCc1ccccc1
InChIInChI=1S/C13H22O2Si/c1-16(14,15)12-8-3-2-5-9-13-10-6-4-7-11-13/h4,6-7,10-11,14-15H,2-3,5,8-9,12H2,1H3
InChIKeyRRPWMGUAHSAMSP-UHFFFAOYSA-N
MW238.40 g/mol
LogP2.85
Rot. Bonds7

About dihydroxy-methyl-(6-phenylhexyl)silane

dihydroxy-methyl-(6-phenylhexyl)silane (PubChem CID 11586756) has the molecular formula C13H22O2Si and a molecular weight of 238.40 g/mol. Its IUPAC name is dihydroxy-methyl-(6-phenylhexyl)silane.

Molecular Properties

Compound Namedihydroxy-methyl-(6-phenylhexyl)silane
PubChem CID11586756
Molecular FormulaC13H22O2Si
Molecular Weight238.40 g/mol
Exact Mass238.14
IUPAC Namedihydroxy-methyl-(6-phenylhexyl)silane
SMILESC[Si](O)(O)CCCCCCc1ccccc1
InChIInChI=1S/C13H22O2Si/c1-16(14,15)12-8-3-2-5-9-13-10-6-4-7-11-13/h4,6-7,10-11,14-15H,2-3,5,8-9,12H2,1H3
InChIKeyRRPWMGUAHSAMSP-UHFFFAOYSA-N
XLogP2.85
TPSA40.46 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds7
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500238.40
LogP ≤ 52.85
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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

trimethoxy(12-phenyldodecyl)silane
CID 54325157
trichloro(5-phenylpentyl)silane
CID 59465093
4-phenylbutylbenzene
CID 141301927
hexylbenzene;hydrogen peroxide
CID 90001206
tetrakis(3-phenylpropyl)silane
CID 4606835
hafnium;4-phenylbutylbenzene
CID 175889972
methane;4-phenylbutylbenzene
CID 173386802
octylbenzene
CID 16607
octacosylbenzene
CID 14228596
pentadecane;pentadecylbenzene
CID 174970881
octaoctacontylbenzene
CID 165359374
pentanonacontylbenzene
CID 165359347

Frequently Asked Questions

What is the IUPAC name of dihydroxy-methyl-(6-phenylhexyl)silane?
The IUPAC name of dihydroxy-methyl-(6-phenylhexyl)silane (CID 11586756) is dihydroxy-methyl-(6-phenylhexyl)silane.
What is the SMILES notation for dihydroxy-methyl-(6-phenylhexyl)silane?
The canonical SMILES for dihydroxy-methyl-(6-phenylhexyl)silane is C[Si](O)(O)CCCCCCc1ccccc1.
What is the InChIKey of dihydroxy-methyl-(6-phenylhexyl)silane?
The InChIKey is RRPWMGUAHSAMSP-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H22O2Si/c1-16(14,15)12-8-3-2-5-9-13-10-6-4-7-11-13/h4,6-7,10-11,14-15H,2-3,5,8-9,12H2,1H3.
What are the key properties of dihydroxy-methyl-(6-phenylhexyl)silane?
dihydroxy-methyl-(6-phenylhexyl)silane has a molecular weight of 238.40 g/mol, XLogP of 2.85, 7 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for dihydroxy-methyl-(6-phenylhexyl)silane is sourced from PubChem (CID 11586756), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).