ethene;4-ethyl-2-methylhept-1-ene

C12H24 — CID 142412124

IUPACethene;4-ethyl-2-methylhept-1-ene
SMILESC=C.C=C(C)CC(CC)CCC
InChIInChI=1S/C10H20.C2H4/c1-5-7-10(6-2)8-9(3)4;1-2/h10H,3,5-8H2,1-2,4H3;1-2H2
InChIKeyKWXWDSULEWUIFG-UHFFFAOYSA-N
MW168.32 g/mol
LogP4.58
Rot. Bonds5

About ethene;4-ethyl-2-methylhept-1-ene

ethene;4-ethyl-2-methylhept-1-ene (PubChem CID 142412124) has the molecular formula C12H24 and a molecular weight of 168.32 g/mol. Its IUPAC name is ethene;4-ethyl-2-methylhept-1-ene.

Molecular Properties

Compound Nameethene;4-ethyl-2-methylhept-1-ene
PubChem CID142412124
Molecular FormulaC12H24
Molecular Weight168.32 g/mol
Exact Mass168.19
IUPAC Nameethene;4-ethyl-2-methylhept-1-ene
SMILESC=C.C=C(C)CC(CC)CCC
InChIInChI=1S/C10H20.C2H4/c1-5-7-10(6-2)8-9(3)4;1-2/h10H,3,5-8H2,1-2,4H3;1-2H2
InChIKeyKWXWDSULEWUIFG-UHFFFAOYSA-N
XLogP4.58
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds5
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500168.32
LogP ≤ 54.58
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

4-ethyl-2,6-dimethylnon-1-ene
CID 90949298
(4S)-4-ethylheptan-2-one
CID 87332428
2-methyloct-1-ene-4,5-diol
CID 103454915
3-methylhexane;2-methylprop-1-ene
CID 165405684
4-ethylheptane;methane
CID 143165373
7-ethyl-2-methylundec-1-en-5-one
CID 139807060
5-ethyl-2-methylnon-1-ene
CID 23205953
1-(2-ethyl-4-methylpent-4-enyl)-4-methylbenzene
CID 169120124
bis(3-ethylhexanoyloxy)bismuthanyl 3-ethylhexanoate
CID 141441146
5-ethyl-2,4-dimethylnon-1-ene
CID 145461999
5-methoxy-2-methyloct-1-en-4-ol
CID 116711758
3,6-dimethyl-4-propylhept-6-en-2-amine
CID 134183824

Frequently Asked Questions

What is the IUPAC name of ethene;4-ethyl-2-methylhept-1-ene?
The IUPAC name of ethene;4-ethyl-2-methylhept-1-ene (CID 142412124) is ethene;4-ethyl-2-methylhept-1-ene.
What is the SMILES notation for ethene;4-ethyl-2-methylhept-1-ene?
The canonical SMILES for ethene;4-ethyl-2-methylhept-1-ene is C=C.C=C(C)CC(CC)CCC.
What is the InChIKey of ethene;4-ethyl-2-methylhept-1-ene?
The InChIKey is KWXWDSULEWUIFG-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H20.C2H4/c1-5-7-10(6-2)8-9(3)4;1-2/h10H,3,5-8H2,1-2,4H3;1-2H2.
What are the key properties of ethene;4-ethyl-2-methylhept-1-ene?
ethene;4-ethyl-2-methylhept-1-ene has a molecular weight of 168.32 g/mol, XLogP of 4.58, 5 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for ethene;4-ethyl-2-methylhept-1-ene is sourced from PubChem (CID 142412124), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).