1,2-diethylbenzene;ethylbenzene;molybdenum

C18H24Mo — CID 174058694

IUPAC1,2-diethylbenzene;ethylbenzene;molybdenum
SMILESCCc1ccccc1.CCc1ccccc1CC.[Mo]
InChIInChI=1S/C10H14.C8H10.Mo/c1-3-9-7-5-6-8-10(9)4-2;1-2-8-6-4-3-5-7-8;/h5-8H,3-4H2,1-2H3;3-7H,2H2,1H3;
InChIKeyYFYABOPQZQOWNB-UHFFFAOYSA-N
MW336.33 g/mol
LogP5.06
Rot. Bonds3

About 1,2-diethylbenzene;ethylbenzene;molybdenum

1,2-diethylbenzene;ethylbenzene;molybdenum (PubChem CID 174058694) has the molecular formula C18H24Mo and a molecular weight of 336.33 g/mol. Its IUPAC name is 1,2-diethylbenzene;ethylbenzene;molybdenum.

Molecular Properties

Compound Name1,2-diethylbenzene;ethylbenzene;molybdenum
PubChem CID174058694
Molecular FormulaC18H24Mo
Molecular Weight336.33 g/mol
Exact Mass338.09
IUPAC Name1,2-diethylbenzene;ethylbenzene;molybdenum
SMILESCCc1ccccc1.CCc1ccccc1CC.[Mo]
InChIInChI=1S/C10H14.C8H10.Mo/c1-3-9-7-5-6-8-10(9)4-2;1-2-8-6-4-3-5-7-8;/h5-8H,3-4H2,1-2H3;3-7H,2H2,1H3;
InChIKeyYFYABOPQZQOWNB-UHFFFAOYSA-N
XLogP5.06
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500336.33
LogP ≤ 55.06
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

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Related Compounds

ethylbenzene;molybdenum
CID 161189179
ethylcyclodecapentaene
CID 90861705
sulfanium ethylbenzene
CID 22726309
ethane;ethylbenzene
CID 90887003
ethylbenzene;propane;hydroiodide
CID 142182216
ethane;ethylbenzene;propane
CID 91199618
1,2-diethylbenzene;hydrobromide
CID 174973685
ethylbenzene;2-methyl-N-propan-2-ylpropanamide
CID 139213515
carbon monoxide;ethylbenzene
CID 158511344
ethylazanium;ethylbenzene
CID 163634184
ethane;ethylbenzene;methanol
CID 90833594
bicyclo[2.2.0]hexa-1,3,5-triene;ethylbenzene
CID 175075360

Frequently Asked Questions

What is the IUPAC name of 1,2-diethylbenzene;ethylbenzene;molybdenum?
The IUPAC name of 1,2-diethylbenzene;ethylbenzene;molybdenum (CID 174058694) is 1,2-diethylbenzene;ethylbenzene;molybdenum.
What is the SMILES notation for 1,2-diethylbenzene;ethylbenzene;molybdenum?
The canonical SMILES for 1,2-diethylbenzene;ethylbenzene;molybdenum is CCc1ccccc1.CCc1ccccc1CC.[Mo].
What is the InChIKey of 1,2-diethylbenzene;ethylbenzene;molybdenum?
The InChIKey is YFYABOPQZQOWNB-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H14.C8H10.Mo/c1-3-9-7-5-6-8-10(9)4-2;1-2-8-6-4-3-5-7-8;/h5-8H,3-4H2,1-2H3;3-7H,2H2,1H3;.
What are the key properties of 1,2-diethylbenzene;ethylbenzene;molybdenum?
1,2-diethylbenzene;ethylbenzene;molybdenum has a molecular weight of 336.33 g/mol, XLogP of 5.06, 3 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for 1,2-diethylbenzene;ethylbenzene;molybdenum is sourced from PubChem (CID 174058694), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).