1-cyclohexa-1,3-dien-1-ylethylbenzene;osmium

C14H16Os — CID 145295082

IUPAC1-cyclohexa-1,3-dien-1-ylethylbenzene;osmium
SMILESCC(C1=CC=CCC1)c1ccccc1.[Os]
InChIInChI=1S/C14H16.Os/c1-12(13-8-4-2-5-9-13)14-10-6-3-7-11-14;/h2-6,8-10,12H,7,11H2,1H3;
InChIKeySNPKQVCPOPXKJR-UHFFFAOYSA-N
MW374.51 g/mol
LogP4.06
Rot. Bonds2

About 1-cyclohexa-1,3-dien-1-ylethylbenzene;osmium

1-cyclohexa-1,3-dien-1-ylethylbenzene;osmium (PubChem CID 145295082) has the molecular formula C14H16Os and a molecular weight of 374.51 g/mol. Its IUPAC name is 1-cyclohexa-1,3-dien-1-ylethylbenzene;osmium.

Molecular Properties

Compound Name1-cyclohexa-1,3-dien-1-ylethylbenzene;osmium
PubChem CID145295082
Molecular FormulaC14H16Os
Molecular Weight374.51 g/mol
Exact Mass376.09
IUPAC Name1-cyclohexa-1,3-dien-1-ylethylbenzene;osmium
SMILESCC(C1=CC=CCC1)c1ccccc1.[Os]
InChIInChI=1S/C14H16.Os/c1-12(13-8-4-2-5-9-13)14-10-6-3-7-11-14;/h2-6,8-10,12H,7,11H2,1H3;
InChIKeySNPKQVCPOPXKJR-UHFFFAOYSA-N
XLogP4.06
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds2
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500374.51
LogP ≤ 54.06
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

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Related Compounds

1-cyclopenta-1,3-dien-1-ylethylbenzene
CID 11116496
1-butan-2-ylcyclohexa-1,3-diene;toluene;1,4-xylene
CID 144821200
(2S)-2-amino-3-cyclohexa-1,3-dien-1-yl-3-phenylpropanoic acid
CID 71096762
cyclohexa-1,3-dien-1-yl(phenyl)silane
CID 154538324
1-phenylethylbenzene
CID 142851428
1-phenylethylbenzene
CID 11918
3-(1-phenylethyl)cyclohepta-1,3,5-triene
CID 123815989
(S)-cyclopenta-1,3-dien-1-yl(phenyl)methanamine
CID 12637323
1-[(2R)-1-bromopropan-2-yl]cyclohexa-1,3-diene
CID 10921559
2-cyclohexa-1,3-dien-1-ylpropan-1-ol
CID 118601022
1-phenylethylbenzene;stibane
CID 174965918
ethane;1-phenylethylbenzene
CID 164998811

Frequently Asked Questions

What is the IUPAC name of 1-cyclohexa-1,3-dien-1-ylethylbenzene;osmium?
The IUPAC name of 1-cyclohexa-1,3-dien-1-ylethylbenzene;osmium (CID 145295082) is 1-cyclohexa-1,3-dien-1-ylethylbenzene;osmium.
What is the SMILES notation for 1-cyclohexa-1,3-dien-1-ylethylbenzene;osmium?
The canonical SMILES for 1-cyclohexa-1,3-dien-1-ylethylbenzene;osmium is CC(C1=CC=CCC1)c1ccccc1.[Os].
What is the InChIKey of 1-cyclohexa-1,3-dien-1-ylethylbenzene;osmium?
The InChIKey is SNPKQVCPOPXKJR-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H16.Os/c1-12(13-8-4-2-5-9-13)14-10-6-3-7-11-14;/h2-6,8-10,12H,7,11H2,1H3;.
What are the key properties of 1-cyclohexa-1,3-dien-1-ylethylbenzene;osmium?
1-cyclohexa-1,3-dien-1-ylethylbenzene;osmium has a molecular weight of 374.51 g/mol, XLogP of 4.06, 2 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for 1-cyclohexa-1,3-dien-1-ylethylbenzene;osmium is sourced from PubChem (CID 145295082), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).