1,5-dimethyl-6-phenylsilylcyclohexa-2,4-dien-1-ol

C14H18OSi — CID 173418091

IUPAC1,5-dimethyl-6-phenylsilylcyclohexa-2,4-dien-1-ol
SMILESCC1=CC=CC(C)(O)C1[SiH2]c1ccccc1
InChIInChI=1S/C14H18OSi/c1-11-7-6-10-14(2,15)13(11)16-12-8-4-3-5-9-12/h3-10,13,15H,16H2,1-2H3
InChIKeyNKAQFNANJMVRFR-UHFFFAOYSA-N
MW230.38 g/mol
LogP1.54
Rot. Bonds2

About 1,5-dimethyl-6-phenylsilylcyclohexa-2,4-dien-1-ol

1,5-dimethyl-6-phenylsilylcyclohexa-2,4-dien-1-ol (PubChem CID 173418091) has the molecular formula C14H18OSi and a molecular weight of 230.38 g/mol. Its IUPAC name is 1,5-dimethyl-6-phenylsilylcyclohexa-2,4-dien-1-ol.

Molecular Properties

Compound Name1,5-dimethyl-6-phenylsilylcyclohexa-2,4-dien-1-ol
PubChem CID173418091
Molecular FormulaC14H18OSi
Molecular Weight230.38 g/mol
Exact Mass230.11
IUPAC Name1,5-dimethyl-6-phenylsilylcyclohexa-2,4-dien-1-ol
SMILESCC1=CC=CC(C)(O)C1[SiH2]c1ccccc1
InChIInChI=1S/C14H18OSi/c1-11-7-6-10-14(2,15)13(11)16-12-8-4-3-5-9-12/h3-10,13,15H,16H2,1-2H3
InChIKeyNKAQFNANJMVRFR-UHFFFAOYSA-N
XLogP1.54
TPSA20.23 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500230.38
LogP ≤ 51.54
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

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

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Related Compounds

6-chloro-1,5-dimethylcyclohexa-2,4-dien-1-ol;1,2-xylene
CID 174712067
(2,4-dimethylcyclopenta-2,4-dien-1-yl)-phenylsilane
CID 174668523
1,5-dimethyl-6-nitrocyclohexa-2,4-dien-1-ol
CID 175278219
6-amino-5-methyl-1-phenylcyclohexa-2,4-diene-1-carboxylic acid
CID 70448919
(1-hydroxy-5,6-dimethylcyclohexa-2,4-dien-1-yl)-phenylmethanone
CID 150290031
5-(2,3-dimethylphenyl)-1,6-dimethylcyclohexa-2,4-dien-1-ol;phenol;bis(1,2-xylene)
CID 161068113
6-bromo-2,6-dimethylcyclohexa-2,4-dien-1-ol
CID 21293799
(6-hydroxy-6-methylcyclohexa-2,4-dien-1-yl)-phenylmethanone
CID 154355270
1-amino-5,6-dimethylcyclohexa-2,4-dien-1-ol
CID 70634940
1-methyl-4-phenylcyclohepta-2,4,6-trien-1-ol
CID 145162638
1,5-dimethyl-4a,8a-dihydronaphthalene
CID 15555373
phosphoroso-(2,6,6-trimethylcyclohexa-2,4-dien-1-yl)methanone
CID 175825539

Frequently Asked Questions

What is the IUPAC name of 1,5-dimethyl-6-phenylsilylcyclohexa-2,4-dien-1-ol?
The IUPAC name of 1,5-dimethyl-6-phenylsilylcyclohexa-2,4-dien-1-ol (CID 173418091) is 1,5-dimethyl-6-phenylsilylcyclohexa-2,4-dien-1-ol.
What is the SMILES notation for 1,5-dimethyl-6-phenylsilylcyclohexa-2,4-dien-1-ol?
The canonical SMILES for 1,5-dimethyl-6-phenylsilylcyclohexa-2,4-dien-1-ol is CC1=CC=CC(C)(O)C1[SiH2]c1ccccc1.
What is the InChIKey of 1,5-dimethyl-6-phenylsilylcyclohexa-2,4-dien-1-ol?
The InChIKey is NKAQFNANJMVRFR-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H18OSi/c1-11-7-6-10-14(2,15)13(11)16-12-8-4-3-5-9-12/h3-10,13,15H,16H2,1-2H3.
What are the key properties of 1,5-dimethyl-6-phenylsilylcyclohexa-2,4-dien-1-ol?
1,5-dimethyl-6-phenylsilylcyclohexa-2,4-dien-1-ol has a molecular weight of 230.38 g/mol, XLogP of 1.54, 2 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 1,5-dimethyl-6-phenylsilylcyclohexa-2,4-dien-1-ol is sourced from PubChem (CID 173418091), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).