(2S)-1-[tert-butyl(dimethyl)silyl]oxypent-4-en-2-ol

C11H24O2Si — CID 11148647

IUPAC(2S)-1-[tert-butyl(dimethyl)silyl]oxypent-4-en-2-ol
SMILESC=CC[C@H](O)CO[Si](C)(C)C(C)(C)C
InChIInChI=1S/C11H24O2Si/c1-7-8-10(12)9-13-14(5,6)11(2,3)4/h7,10,12H,1,8-9H2,2-6H3/t10-/m0/s1
InChIKeyYEFZAVCKLWHUHJ-JTQLQIEISA-N
MW216.40 g/mol
LogP2.95
Rot. Bonds5

About (2S)-1-[tert-butyl(dimethyl)silyl]oxypent-4-en-2-ol

(2S)-1-[tert-butyl(dimethyl)silyl]oxypent-4-en-2-ol (PubChem CID 11148647) has the molecular formula C11H24O2Si and a molecular weight of 216.40 g/mol. Its IUPAC name is (2S)-1-[tert-butyl(dimethyl)silyl]oxypent-4-en-2-ol.

Molecular Properties

Compound Name(2S)-1-[tert-butyl(dimethyl)silyl]oxypent-4-en-2-ol
PubChem CID11148647
Molecular FormulaC11H24O2Si
Molecular Weight216.40 g/mol
Exact Mass216.15
IUPAC Name(2S)-1-[tert-butyl(dimethyl)silyl]oxypent-4-en-2-ol
SMILESC=CC[C@H](O)CO[Si](C)(C)C(C)(C)C
InChIInChI=1S/C11H24O2Si/c1-7-8-10(12)9-13-14(5,6)11(2,3)4/h7,10,12H,1,8-9H2,2-6H3/t10-/m0/s1
InChIKeyYEFZAVCKLWHUHJ-JTQLQIEISA-N
XLogP2.95
TPSA29.46 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500216.40
LogP ≤ 52.95
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Related Compounds

1-[2,3-dimethylbutan-2-yl(dimethyl)silyl]oxypent-4-en-2-ol
CID 10955810
(2R,3R)-1-[tert-butyl(dimethyl)silyl]oxy-2-methylhex-5-en-3-ol
CID 11276618
(4S)-2-[[tert-butyl(dimethyl)silyl]oxymethyl]hepta-1,6-dien-4-ol
CID 135040202
(2S)-1-[tert-butyl(dimethyl)silyl]oxybutan-2-ol
CID 86606837
(4R,6R,8S)-8-[tert-butyl(dimethyl)silyl]oxynon-1-ene-4,6-diol
CID 10935112
(2S,3Z,6S)-1-[tert-butyl(dimethyl)silyl]oxyocta-3,7-diene-2,6-diol
CID 10540140
1-[tert-butyl(dimethyl)silyl]oxypropan-2-ol
CID 13175134
1-[tert-butyl(dimethyl)silyl]oxypentan-2-ol
CID 10608878
(2S)-3-[tert-butyl(dimethyl)silyl]oxy-2-prop-2-enoxypropan-1-ol
CID 125487080
(2R,3R,4R,5R)-1,6-bis[[tert-butyl(dimethyl)silyl]oxy]hexane-2,3,4,5-tetrol
CID 11486689
(1S)-1-[(1R,2R)-2-[[tert-butyl(dimethyl)silyl]oxymethyl]cyclopropyl]but-3-en-1-ol
CID 10682540
tert-butyl-[[(2R)-1-[tert-butyl(dimethyl)silyl]oxypent-4-en-2-yl]amino]-oxidosulfanium
CID 175168614

Frequently Asked Questions

What is the IUPAC name of (2S)-1-[tert-butyl(dimethyl)silyl]oxypent-4-en-2-ol?
The IUPAC name of (2S)-1-[tert-butyl(dimethyl)silyl]oxypent-4-en-2-ol (CID 11148647) is (2S)-1-[tert-butyl(dimethyl)silyl]oxypent-4-en-2-ol.
What is the SMILES notation for (2S)-1-[tert-butyl(dimethyl)silyl]oxypent-4-en-2-ol?
The canonical SMILES for (2S)-1-[tert-butyl(dimethyl)silyl]oxypent-4-en-2-ol is C=CC[C@H](O)CO[Si](C)(C)C(C)(C)C.
What is the InChIKey of (2S)-1-[tert-butyl(dimethyl)silyl]oxypent-4-en-2-ol?
The InChIKey is YEFZAVCKLWHUHJ-JTQLQIEISA-N. The full InChI is InChI=1S/C11H24O2Si/c1-7-8-10(12)9-13-14(5,6)11(2,3)4/h7,10,12H,1,8-9H2,2-6H3/t10-/m0/s1.
What are the key properties of (2S)-1-[tert-butyl(dimethyl)silyl]oxypent-4-en-2-ol?
(2S)-1-[tert-butyl(dimethyl)silyl]oxypent-4-en-2-ol has a molecular weight of 216.40 g/mol, XLogP of 2.95, 5 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (2S)-1-[tert-butyl(dimethyl)silyl]oxypent-4-en-2-ol is sourced from PubChem (CID 11148647), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).