2-butyl-5-methylcyclopenta-1,3-diene;hafnium

C10H16Hf — CID 174884437

IUPAC2-butyl-5-methylcyclopenta-1,3-diene;hafnium
SMILESCCCCC1=CC(C)C=C1.[Hf]
InChIInChI=1S/C10H16.Hf/c1-3-4-5-10-7-6-9(2)8-10;/h6-9H,3-5H2,1-2H3;
InChIKeyVJBHJGMDOCJWBO-UHFFFAOYSA-N
MW314.73 g/mol
LogP3.31
Rot. Bonds3

About 2-butyl-5-methylcyclopenta-1,3-diene;hafnium

2-butyl-5-methylcyclopenta-1,3-diene;hafnium (PubChem CID 174884437) has the molecular formula C10H16Hf and a molecular weight of 314.73 g/mol. Its IUPAC name is 2-butyl-5-methylcyclopenta-1,3-diene;hafnium.

Molecular Properties

Compound Name2-butyl-5-methylcyclopenta-1,3-diene;hafnium
PubChem CID174884437
Molecular FormulaC10H16Hf
Molecular Weight314.73 g/mol
Exact Mass316.07
IUPAC Name2-butyl-5-methylcyclopenta-1,3-diene;hafnium
SMILESCCCCC1=CC(C)C=C1.[Hf]
InChIInChI=1S/C10H16.Hf/c1-3-4-5-10-7-6-9(2)8-10;/h6-9H,3-5H2,1-2H3;
InChIKeyVJBHJGMDOCJWBO-UHFFFAOYSA-N
XLogP3.31
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds3
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500314.73
LogP ≤ 53.31
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

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Related Compounds

2-butyl-5-methylcyclopenta-1,3-diene;zirconium
CID 174290613
2-butyl-5-methylcyclopenta-1,3-diene;difluorozirconium
CID 174700660
2-butyl-5-methylcyclopenta-1,3-diene;dichlorotitanium
CID 174487779
chloro-dimethyl-(3-octylcyclopenta-2,4-dien-1-yl)silane
CID 141235544
(3-butylcyclopenta-2,4-dien-1-yl)-ethyl-methyl-phenylsilane
CID 174668494
(4-pentylcyclohexa-2,4-dien-1-yl)boronic acid
CID 134064083
6-pentyl-2-propylcyclohexa-1,3-diene
CID 144896807
2-butylcyclopenta-1,3-diene;hafnium;dibromide
CID 174700616
(6R)-6-chloro-2-ethyl-5-undecylcyclohexa-1,3-diene
CID 130459982
(9aR,9bS)-8-propyl-9a,9b-dihydrobenzo[e][1]benzofuran
CID 100992450
(1E,3Z,5Z)-2-hexyl-4,7-dimethylcycloocta-1,3,5-triene
CID 143192924
2,7-dibutyl-9-(2-cyclopentylhex-5-en-2-yl)-4b,8a,9,9a-tetrahydro-4aH-fluorene
CID 144816897

Frequently Asked Questions

What is the IUPAC name of 2-butyl-5-methylcyclopenta-1,3-diene;hafnium?
The IUPAC name of 2-butyl-5-methylcyclopenta-1,3-diene;hafnium (CID 174884437) is 2-butyl-5-methylcyclopenta-1,3-diene;hafnium.
What is the SMILES notation for 2-butyl-5-methylcyclopenta-1,3-diene;hafnium?
The canonical SMILES for 2-butyl-5-methylcyclopenta-1,3-diene;hafnium is CCCCC1=CC(C)C=C1.[Hf].
What is the InChIKey of 2-butyl-5-methylcyclopenta-1,3-diene;hafnium?
The InChIKey is VJBHJGMDOCJWBO-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H16.Hf/c1-3-4-5-10-7-6-9(2)8-10;/h6-9H,3-5H2,1-2H3;.
What are the key properties of 2-butyl-5-methylcyclopenta-1,3-diene;hafnium?
2-butyl-5-methylcyclopenta-1,3-diene;hafnium has a molecular weight of 314.73 g/mol, XLogP of 3.31, 3 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for 2-butyl-5-methylcyclopenta-1,3-diene;hafnium is sourced from PubChem (CID 174884437), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).