ethane;(E)-hex-2-ene

C10H24 — CID 142405633

IUPACethane;(E)-hex-2-ene
SMILESC/C=C/CCC.CC.CC
InChIInChI=1S/C6H12.2C2H6/c1-3-5-6-4-2;2*1-2/h3,5H,4,6H2,1-2H3;2*1-2H3/b5-3+;;
InChIKeyRQMDGEYDBJKTLC-RQCPZROWSA-N
MW144.30 g/mol
LogP4.41
Rot. Bonds2

About ethane;(E)-hex-2-ene

ethane;(E)-hex-2-ene (PubChem CID 142405633) has the molecular formula C10H24 and a molecular weight of 144.30 g/mol. Its IUPAC name is ethane;(E)-hex-2-ene.

Molecular Properties

Compound Nameethane;(E)-hex-2-ene
PubChem CID142405633
Molecular FormulaC10H24
Molecular Weight144.30 g/mol
Exact Mass144.19
IUPAC Nameethane;(E)-hex-2-ene
SMILESC/C=C/CCC.CC.CC
InChIInChI=1S/C6H12.2C2H6/c1-3-5-6-4-2;2*1-2/h3,5H,4,6H2,1-2H3;2*1-2H3/b5-3+;;
InChIKeyRQMDGEYDBJKTLC-RQCPZROWSA-N
XLogP4.41
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds2
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500144.30
LogP ≤ 54.41
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

Computed Properties (RDKit)

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

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Related Compounds

butane;ethane;(E)-hex-2-ene
CID 143010099
(6Z)-deca-2,6-diene
CID 159397578
but-2-ene;hex-2-ene;oct-4-ene;ruthenium
CID 161087465
(Z)-hex-2-ene;(E)-hex-2-ene;(E)-hex-3-ene
CID 173035981
hexane;(Z)-hex-2-ene
CID 159343029
ethane;(E)-oct-4-ene
CID 142055407
acetic acid;(E)-hex-2-ene
CID 174958018
hex-2-ene;3-methylpentane
CID 161117572
acetaldehyde;hexane;bis((E)-hex-2-ene);pentane
CID 160632813
carbamic acid;(E)-hex-2-ene
CID 174912639
(2Z,4Z,6E)-deca-2,4,6-triene;ethane;methane
CID 178167851
(Z)-oct-2-ene
CID 5356796

Frequently Asked Questions

What is the IUPAC name of ethane;(E)-hex-2-ene?
The IUPAC name of ethane;(E)-hex-2-ene (CID 142405633) is ethane;(E)-hex-2-ene.
What is the SMILES notation for ethane;(E)-hex-2-ene?
The canonical SMILES for ethane;(E)-hex-2-ene is C/C=C/CCC.CC.CC.
What is the InChIKey of ethane;(E)-hex-2-ene?
The InChIKey is RQMDGEYDBJKTLC-RQCPZROWSA-N. The full InChI is InChI=1S/C6H12.2C2H6/c1-3-5-6-4-2;2*1-2/h3,5H,4,6H2,1-2H3;2*1-2H3/b5-3+;;.
What are the key properties of ethane;(E)-hex-2-ene?
ethane;(E)-hex-2-ene has a molecular weight of 144.30 g/mol, XLogP of 4.41, 2 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for ethane;(E)-hex-2-ene is sourced from PubChem (CID 142405633), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).