dimethyl-[methyl-[2-[[methyl(diphenyl)silyl]methyl]phenyl]-naphthalen-1-ylsilyl]-phenylsilane

C39H40Si3 — CID 12030742

IUPACdimethyl-[methyl-[2-[[methyl(diphenyl)silyl]methyl]phenyl]-naphthalen-1-ylsilyl]-phenylsilane
SMILESC[Si](Cc1ccccc1[Si](C)(c1cccc2ccccc12)[Si](C)(C)c1ccccc1)(c1ccccc1)c1ccccc1
InChIInChI=1S/C39H40Si3/c1-40(2,34-22-8-5-9-23-34)42(4,39-30-18-21-32-19-14-16-28-37(32)39)38-29-17-15-20-33(38)31-41(3,35-24-10-6-11-25-35)36-26-12-7-13-27-36/h5-30H,31H2,1-4H3
InChIKeyCKHCJBWFXHSNPW-UHFFFAOYSA-N
MW593.01 g/mol
LogP6.70
Rot. Bonds8

About dimethyl-[methyl-[2-[[methyl(diphenyl)silyl]methyl]phenyl]-naphthalen-1-ylsilyl]-phenylsilane

dimethyl-[methyl-[2-[[methyl(diphenyl)silyl]methyl]phenyl]-naphthalen-1-ylsilyl]-phenylsilane (PubChem CID 12030742) has the molecular formula C39H40Si3 and a molecular weight of 593.01 g/mol. Its IUPAC name is dimethyl-[methyl-[2-[[methyl(diphenyl)silyl]methyl]phenyl]-naphthalen-1-ylsilyl]-phenylsilane.

Molecular Properties

Compound Namedimethyl-[methyl-[2-[[methyl(diphenyl)silyl]methyl]phenyl]-naphthalen-1-ylsilyl]-phenylsilane
PubChem CID12030742
Molecular FormulaC39H40Si3
Molecular Weight593.01 g/mol
Exact Mass592.24
IUPAC Namedimethyl-[methyl-[2-[[methyl(diphenyl)silyl]methyl]phenyl]-naphthalen-1-ylsilyl]-phenylsilane
SMILESC[Si](Cc1ccccc1[Si](C)(c1cccc2ccccc12)[Si](C)(C)c1ccccc1)(c1ccccc1)c1ccccc1
InChIInChI=1S/C39H40Si3/c1-40(2,34-22-8-5-9-23-34)42(4,39-30-18-21-32-19-14-16-28-37(32)39)38-29-17-15-20-33(38)31-41(3,35-24-10-6-11-25-35)36-26-12-7-13-27-36/h5-30H,31H2,1-4H3
InChIKeyCKHCJBWFXHSNPW-UHFFFAOYSA-N
XLogP6.70
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds8
Heavy Atoms42
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 500593.01
LogP ≤ 56.70
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

Computed Properties (RDKit)

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

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Related Compounds

butyl-[2-[[dimethyl(phenyl)silyl]methyl]phenyl]-methyl-naphthalen-1-ylsilane
CID 12030739
methyl-naphthalen-1-yl-phenyl-prop-2-enylsilane
CID 12598487
bis[2-(hydroxy-naphthalen-1-yl-phenylsilyl)ethyl]-dimethylsilane
CID 102005003
chloro-methyl-dinaphthalen-1-ylsilane
CID 140861802
(1R)-N-(methyl-naphthalen-1-yl-phenylsilyl)-1-phenyl-N-[(1R)-1-phenylethyl]ethanamine
CID 100943831
methyl-[(2-methylpropan-2-yl)oxy]-naphthalen-1-yl-phenylsilane
CID 10990843
trimethyl(phenanthren-4-ylmethyl)silane
CID 58825790
(4-ethynylphenyl)-methyl-naphthalen-1-yl-phenylsilane
CID 101072929
dimethyl-(4-naphthalen-1-ylbutyl)-phenylsilane
CID 102040276
(4,4-dimethylcyclohexa-1,5-dien-1-yl)-methyl-naphthalen-1-yl-phenylsilane
CID 13056160
1-[2-(methoxy-naphthalen-1-yl-triphenylsilyloxysilyl)phenyl]-N,N-dimethylmethanamine
CID 134949039
methyl-[(3-methylphenyl)methyl]-diphenylsilane
CID 139831843

Frequently Asked Questions

What is the IUPAC name of dimethyl-[methyl-[2-[[methyl(diphenyl)silyl]methyl]phenyl]-naphthalen-1-ylsilyl]-phenylsilane?
The IUPAC name of dimethyl-[methyl-[2-[[methyl(diphenyl)silyl]methyl]phenyl]-naphthalen-1-ylsilyl]-phenylsilane (CID 12030742) is dimethyl-[methyl-[2-[[methyl(diphenyl)silyl]methyl]phenyl]-naphthalen-1-ylsilyl]-phenylsilane.
What is the SMILES notation for dimethyl-[methyl-[2-[[methyl(diphenyl)silyl]methyl]phenyl]-naphthalen-1-ylsilyl]-phenylsilane?
The canonical SMILES for dimethyl-[methyl-[2-[[methyl(diphenyl)silyl]methyl]phenyl]-naphthalen-1-ylsilyl]-phenylsilane is C[Si](Cc1ccccc1[Si](C)(c1cccc2ccccc12)[Si](C)(C)c1ccccc1)(c1ccccc1)c1ccccc1.
What is the InChIKey of dimethyl-[methyl-[2-[[methyl(diphenyl)silyl]methyl]phenyl]-naphthalen-1-ylsilyl]-phenylsilane?
The InChIKey is CKHCJBWFXHSNPW-UHFFFAOYSA-N. The full InChI is InChI=1S/C39H40Si3/c1-40(2,34-22-8-5-9-23-34)42(4,39-30-18-21-32-19-14-16-28-37(32)39)38-29-17-15-20-33(38)31-41(3,35-24-10-6-11-25-35)36-26-12-7-13-27-36/h5-30H,31H2,1-4H3.
What are the key properties of dimethyl-[methyl-[2-[[methyl(diphenyl)silyl]methyl]phenyl]-naphthalen-1-ylsilyl]-phenylsilane?
dimethyl-[methyl-[2-[[methyl(diphenyl)silyl]methyl]phenyl]-naphthalen-1-ylsilyl]-phenylsilane has a molecular weight of 593.01 g/mol, XLogP of 6.70, 8 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for dimethyl-[methyl-[2-[[methyl(diphenyl)silyl]methyl]phenyl]-naphthalen-1-ylsilyl]-phenylsilane is sourced from PubChem (CID 12030742), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).