lithium pent-2-ene

C5H9Li — CID 85106619

IUPAClithium pent-2-ene
SMILES[CH2-]CC=CC.[Li+]
InChIInChI=1S/C5H9.Li/c1-3-5-4-2;/h4-5H,1,3H2,2H3;/q-1;+1
InChIKeyZGXDHOMWRCMHPI-UHFFFAOYSA-N
MW76.07 g/mol
LogP-1.21
Rot. Bonds1

About lithium pent-2-ene

lithium pent-2-ene (PubChem CID 85106619) has the molecular formula C5H9Li and a molecular weight of 76.07 g/mol. Its IUPAC name is lithium pent-2-ene.

Molecular Properties

Compound Namelithium pent-2-ene
PubChem CID85106619
Molecular FormulaC5H9Li
Molecular Weight76.07 g/mol
Exact Mass76.09
IUPAC Namelithium pent-2-ene
SMILES[CH2-]CC=CC.[Li+]
InChIInChI=1S/C5H9.Li/c1-3-5-4-2;/h4-5H,1,3H2,2H3;/q-1;+1
InChIKeyZGXDHOMWRCMHPI-UHFFFAOYSA-N
XLogP-1.21
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds1
Heavy Atoms6
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 50076.07
LogP ≤ 5-1.21
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Carbo_cation/anion', 'substructure': 'N/A'}, {'alert_name': 'isolated_alkene', 'substructure': 'N/A'}

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Related Compounds

trans-2-Pentene
CID 5326161
4-Methyl-2-pentene, (2Z)-
CID 5326159
cis-2-PENTENE
CID 5326160
1,4-Hexadiene
CID 11599
3-Heptene
CID 11612
Hex-2-ene
CID 19966
Pent-2-ene
CID 12585
Hexene
CID 639661
2-Heptene
CID 11611
(E)-4,4-Dimethylpent-2-ene
CID 5326158
1,4-Cyclohexadiene
CID 12343
trans-1,4-Hexadiene
CID 5365552

Frequently Asked Questions

What is the IUPAC name of lithium pent-2-ene?
The IUPAC name of lithium pent-2-ene (CID 85106619) is lithium pent-2-ene.
What is the SMILES notation for lithium pent-2-ene?
The canonical SMILES for lithium pent-2-ene is [CH2-]CC=CC.[Li+].
What is the InChIKey of lithium pent-2-ene?
The InChIKey is ZGXDHOMWRCMHPI-UHFFFAOYSA-N. The full InChI is InChI=1S/C5H9.Li/c1-3-5-4-2;/h4-5H,1,3H2,2H3;/q-1;+1.
What are the key properties of lithium pent-2-ene?
lithium pent-2-ene has a molecular weight of 76.07 g/mol, XLogP of -1.21, 1 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for lithium pent-2-ene is sourced from PubChem (CID 85106619), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).