(3S)-3-methyl-6-trimethylsilylhex-5-yn-3-ol

C10H20OSi — CID 53483592

IUPAC(3S)-3-methyl-6-trimethylsilylhex-5-yn-3-ol
SMILESCC[C@](C)(O)CC#C[Si](C)(C)C
InChIInChI=1S/C10H20OSi/c1-6-10(2,11)8-7-9-12(3,4)5/h11H,6,8H2,1-5H3/t10-/m0/s1
InChIKeyUSHOOUQQMRZENP-JTQLQIEISA-N
MW184.35 g/mol
LogP2.42
Rot. Bonds2

About (3S)-3-methyl-6-trimethylsilylhex-5-yn-3-ol

(3S)-3-methyl-6-trimethylsilylhex-5-yn-3-ol (PubChem CID 53483592) has the molecular formula C10H20OSi and a molecular weight of 184.35 g/mol. Its IUPAC name is (3S)-3-methyl-6-trimethylsilylhex-5-yn-3-ol.

Molecular Properties

Compound Name(3S)-3-methyl-6-trimethylsilylhex-5-yn-3-ol
PubChem CID53483592
Molecular FormulaC10H20OSi
Molecular Weight184.35 g/mol
Exact Mass184.13
IUPAC Name(3S)-3-methyl-6-trimethylsilylhex-5-yn-3-ol
SMILESCC[C@](C)(O)CC#C[Si](C)(C)C
InChIInChI=1S/C10H20OSi/c1-6-10(2,11)8-7-9-12(3,4)5/h11H,6,8H2,1-5H3/t10-/m0/s1
InChIKeyUSHOOUQQMRZENP-JTQLQIEISA-N
XLogP2.42
TPSA20.23 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500184.35
LogP ≤ 52.42
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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

2-Methyl-4-(trimethylsilyl)but-3-yn-2-ol
CID 332724
3-Ethyl-1-trimethylsilanyl-pent-1-yn-3-ol
CID 15526815
6-Trimethylsilyl-2-methylhexa-3,5-diyn-2-ol
CID 10678951
3-Methyl-1-(trimethylsilyl)pent-1-yn-3-ol
CID 12630623
3-Ethyl-1-trimethylsilylpentan-3-ol
CID 86177948
6-Dimethylethylsilyl-2-methylhexa-3,5-diyn-2-ol
CID 129806516
3-Methyl-1-trimethylsilylpentan-3-ol
CID 134978613
(3R)-3,4,4-trimethyl-1-trimethylsilylpent-1-yn-3-ol
CID 135054452
3-Ethyl-5,7-bis(trimethylsilyl)hept-6-yn-3-ol
CID 166442138
3-Fluoro-2-methyl-5-tri(propan-2-yl)silylpent-4-yn-2-ol
CID 10540146
4,4-Difluoro-3-methyl-6-tri(propan-2-yl)silylhex-5-yn-3-ol
CID 15495759
2-Methyl-5-trimethylsilylpent-4-yn-2-ol
CID 10442134

Frequently Asked Questions

What is the IUPAC name of (3S)-3-methyl-6-trimethylsilylhex-5-yn-3-ol?
The IUPAC name of (3S)-3-methyl-6-trimethylsilylhex-5-yn-3-ol (CID 53483592) is (3S)-3-methyl-6-trimethylsilylhex-5-yn-3-ol.
What is the SMILES notation for (3S)-3-methyl-6-trimethylsilylhex-5-yn-3-ol?
The canonical SMILES for (3S)-3-methyl-6-trimethylsilylhex-5-yn-3-ol is CC[C@](C)(O)CC#C[Si](C)(C)C.
What is the InChIKey of (3S)-3-methyl-6-trimethylsilylhex-5-yn-3-ol?
The InChIKey is USHOOUQQMRZENP-JTQLQIEISA-N. The full InChI is InChI=1S/C10H20OSi/c1-6-10(2,11)8-7-9-12(3,4)5/h11H,6,8H2,1-5H3/t10-/m0/s1.
What are the key properties of (3S)-3-methyl-6-trimethylsilylhex-5-yn-3-ol?
(3S)-3-methyl-6-trimethylsilylhex-5-yn-3-ol has a molecular weight of 184.35 g/mol, XLogP of 2.42, 2 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for (3S)-3-methyl-6-trimethylsilylhex-5-yn-3-ol is sourced from PubChem (CID 53483592), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).