(1E)-4-methyl-1-trimethylsilylpenta-1,4-dien-3-ol

C9H18OSi — CID 12935877

IUPAC(1E)-4-methyl-1-trimethylsilylpenta-1,4-dien-3-ol
SMILESC=C(C)C(O)/C=C/[Si](C)(C)C
InChIInChI=1S/C9H18OSi/c1-8(2)9(10)6-7-11(3,4)5/h6-7,9-10H,1H2,2-5H3/b7-6+
InChIKeyFNWCUMLNROJVBY-VOTSOKGWSA-N
MW170.33 g/mol
LogP2.36
Rot. Bonds3

About (1E)-4-methyl-1-trimethylsilylpenta-1,4-dien-3-ol

(1E)-4-methyl-1-trimethylsilylpenta-1,4-dien-3-ol (PubChem CID 12935877) has the molecular formula C9H18OSi and a molecular weight of 170.33 g/mol. Its IUPAC name is (1E)-4-methyl-1-trimethylsilylpenta-1,4-dien-3-ol.

Molecular Properties

Compound Name(1E)-4-methyl-1-trimethylsilylpenta-1,4-dien-3-ol
PubChem CID12935877
Molecular FormulaC9H18OSi
Molecular Weight170.33 g/mol
Exact Mass170.11
IUPAC Name(1E)-4-methyl-1-trimethylsilylpenta-1,4-dien-3-ol
SMILESC=C(C)C(O)/C=C/[Si](C)(C)C
InChIInChI=1S/C9H18OSi/c1-8(2)9(10)6-7-11(3,4)5/h6-7,9-10H,1H2,2-5H3/b7-6+
InChIKeyFNWCUMLNROJVBY-VOTSOKGWSA-N
XLogP2.36
TPSA20.23 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds3
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500170.33
LogP ≤ 52.36
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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

(+/-)-trans-4-(Trimethylsilyl)-3-buten-2-ol
CID 10351819
3-[Tert-butyl(dimethyl)silyl]oxypent-4-en-1-ol
CID 17795838
(3R,4S)-4-[tert-butyl(dimethyl)silyl]oxypent-1-en-3-ol
CID 10900062
(Z)-5-trimethylsilylpent-4-en-2-ol
CID 11480588
5-[(tert-Butyldimethylsilyl)oxy]pent-1-en-3-ol
CID 12184694
(3R)-3-[tert-butyl(dimethyl)silyl]oxypent-4-en-1-ol
CID 16752963
(3S,5R)-5-[tert-butyl(dimethyl)silyl]oxyhex-1-en-3-ol
CID 24822910
(3S)-3-[tert-butyl(dimethyl)silyl]oxypent-4-en-1-ol
CID 44190405
3-Buten-2-ol, 4-(trimethylsilyl)-
CID 53756305
(3R)-2-methyl-4-trimethylsilylhexa-4,5-dien-3-ol
CID 10487753
(E)-6-trimethylsilylhex-5-en-3-ol
CID 10702355
(3S,4R)-4-[tert-butyl(dimethyl)silyl]oxypent-1-en-3-ol
CID 11127690

Frequently Asked Questions

What is the IUPAC name of (1E)-4-methyl-1-trimethylsilylpenta-1,4-dien-3-ol?
The IUPAC name of (1E)-4-methyl-1-trimethylsilylpenta-1,4-dien-3-ol (CID 12935877) is (1E)-4-methyl-1-trimethylsilylpenta-1,4-dien-3-ol.
What is the SMILES notation for (1E)-4-methyl-1-trimethylsilylpenta-1,4-dien-3-ol?
The canonical SMILES for (1E)-4-methyl-1-trimethylsilylpenta-1,4-dien-3-ol is C=C(C)C(O)/C=C/[Si](C)(C)C.
What is the InChIKey of (1E)-4-methyl-1-trimethylsilylpenta-1,4-dien-3-ol?
The InChIKey is FNWCUMLNROJVBY-VOTSOKGWSA-N. The full InChI is InChI=1S/C9H18OSi/c1-8(2)9(10)6-7-11(3,4)5/h6-7,9-10H,1H2,2-5H3/b7-6+.
What are the key properties of (1E)-4-methyl-1-trimethylsilylpenta-1,4-dien-3-ol?
(1E)-4-methyl-1-trimethylsilylpenta-1,4-dien-3-ol has a molecular weight of 170.33 g/mol, XLogP of 2.36, 3 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for (1E)-4-methyl-1-trimethylsilylpenta-1,4-dien-3-ol is sourced from PubChem (CID 12935877), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).