trimethyl-[(3R)-3-phenylhept-1-ynyl]silane

C16H24Si — CID 102389836

IUPACtrimethyl-[(3R)-3-phenylhept-1-ynyl]silane
SMILESCCCC[C@@H](C#C[Si](C)(C)C)c1ccccc1
InChIInChI=1S/C16H24Si/c1-5-6-10-16(13-14-17(2,3)4)15-11-8-7-9-12-15/h7-9,11-12,16H,5-6,10H2,1-4H3/t16-/m0/s1
InChIKeyZNNTXJNMKXXXGP-INIZCTEOSA-N
MW244.45 g/mol
LogP4.84
Rot. Bonds4

About trimethyl-[(3R)-3-phenylhept-1-ynyl]silane

trimethyl-[(3R)-3-phenylhept-1-ynyl]silane (PubChem CID 102389836) has the molecular formula C16H24Si and a molecular weight of 244.45 g/mol. Its IUPAC name is trimethyl-[(3R)-3-phenylhept-1-ynyl]silane.

Molecular Properties

Compound Nametrimethyl-[(3R)-3-phenylhept-1-ynyl]silane
PubChem CID102389836
Molecular FormulaC16H24Si
Molecular Weight244.45 g/mol
Exact Mass244.16
IUPAC Nametrimethyl-[(3R)-3-phenylhept-1-ynyl]silane
SMILESCCCC[C@@H](C#C[Si](C)(C)C)c1ccccc1
InChIInChI=1S/C16H24Si/c1-5-6-10-16(13-14-17(2,3)4)15-11-8-7-9-12-15/h7-9,11-12,16H,5-6,10H2,1-4H3/t16-/m0/s1
InChIKeyZNNTXJNMKXXXGP-INIZCTEOSA-N
XLogP4.84
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds4
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500244.45
LogP ≤ 54.84
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

Computed Properties (RDKit)

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

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Related Compounds

(3R)-1-[benzhydryl(dimethyl)silyl]hept-1-yn-3-ol
CID 102018356
(3S)-N,N-dibenzyl-1-trimethylsilylhept-1-yn-3-amine
CID 11473957
10-phenyltetradecan-5-ylbenzene
CID 22891787
(3S)-1-trimethylsilylhept-1-yn-3-ol
CID 12623486
(1S)-1-phenylpentan-1-ol
CID 6992754
CID 173139841
CID 173139841
1-phenyl-N-(2-phenylethyl)-3-trimethylsilylprop-2-yn-1-amine
CID 135004228
[(E)-8-phenyldodec-6-en-5-yl]benzene
CID 14267465
heptan-3-ylbenzene;methane
CID 159006232
1-isocyanopentylbenzene
CID 172755000
(3R,4S)-3-(phenylsulfanylmethyl)-1-trimethylsilylhept-1-yn-4-ol
CID 101124004
3-phenylheptanal
CID 10954355

Frequently Asked Questions

What is the IUPAC name of trimethyl-[(3R)-3-phenylhept-1-ynyl]silane?
The IUPAC name of trimethyl-[(3R)-3-phenylhept-1-ynyl]silane (CID 102389836) is trimethyl-[(3R)-3-phenylhept-1-ynyl]silane.
What is the SMILES notation for trimethyl-[(3R)-3-phenylhept-1-ynyl]silane?
The canonical SMILES for trimethyl-[(3R)-3-phenylhept-1-ynyl]silane is CCCC[C@@H](C#C[Si](C)(C)C)c1ccccc1.
What is the InChIKey of trimethyl-[(3R)-3-phenylhept-1-ynyl]silane?
The InChIKey is ZNNTXJNMKXXXGP-INIZCTEOSA-N. The full InChI is InChI=1S/C16H24Si/c1-5-6-10-16(13-14-17(2,3)4)15-11-8-7-9-12-15/h7-9,11-12,16H,5-6,10H2,1-4H3/t16-/m0/s1.
What are the key properties of trimethyl-[(3R)-3-phenylhept-1-ynyl]silane?
trimethyl-[(3R)-3-phenylhept-1-ynyl]silane has a molecular weight of 244.45 g/mol, XLogP of 4.84, 4 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for trimethyl-[(3R)-3-phenylhept-1-ynyl]silane is sourced from PubChem (CID 102389836), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).