2,2,3,4-tetramethylhex-3-ene

C10H20 — CID 59938599

IUPAC2,2,3,4-tetramethylhex-3-ene
SMILESCCC(C)=C(C)C(C)(C)C
InChIInChI=1S/C10H20/c1-7-8(2)9(3)10(4,5)6/h7H2,1-6H3
InChIKeyBZZNMKJWBUUWTN-UHFFFAOYSA-N
MW140.27 g/mol
LogP3.78
Rot. Bonds1

About 2,2,3,4-tetramethylhex-3-ene

2,2,3,4-tetramethylhex-3-ene (PubChem CID 59938599) has the molecular formula C10H20 and a molecular weight of 140.27 g/mol. Its IUPAC name is 2,2,3,4-tetramethylhex-3-ene.

Molecular Properties

Compound Name2,2,3,4-tetramethylhex-3-ene
PubChem CID59938599
Molecular FormulaC10H20
Molecular Weight140.27 g/mol
Exact Mass140.16
IUPAC Name2,2,3,4-tetramethylhex-3-ene
SMILESCCC(C)=C(C)C(C)(C)C
InChIInChI=1S/C10H20/c1-7-8(2)9(3)10(4,5)6/h7H2,1-6H3
InChIKeyBZZNMKJWBUUWTN-UHFFFAOYSA-N
XLogP3.78
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds1
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500140.27
LogP ≤ 53.78
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

3,4,4-Trimethyl-2-pentene
CID 11738
2,3,4-Trimethylpent-2-ene
CID 11270
3,4,4-Trimethyl-2-pentene, (2E)-
CID 5357254
(E)-3,4-Dimethylhex-3-ene
CID 3034312
3-Heptene, 3,5,5-trimethyl-
CID 74910
(Z)-3,4-dimethylhex-3-ene
CID 3034311
3,4,4-Trimethyl-2-pentene, (2Z)-
CID 5369065
3-Hexene, 2,3,4,5-tetramethyl-, (Z)-
CID 3036382
2-Hexene, 2,3,5,5-tetramethyl-
CID 141765
2-Hexene, 2,4,4-trimethyl
CID 59962795
2,5,5-Trimethyl-2-hexene
CID 545914
(E)-2,3-Di-tert-butyl-2-butene
CID 638064

Frequently Asked Questions

What is the IUPAC name of 2,2,3,4-tetramethylhex-3-ene?
The IUPAC name of 2,2,3,4-tetramethylhex-3-ene (CID 59938599) is 2,2,3,4-tetramethylhex-3-ene.
What is the SMILES notation for 2,2,3,4-tetramethylhex-3-ene?
The canonical SMILES for 2,2,3,4-tetramethylhex-3-ene is CCC(C)=C(C)C(C)(C)C.
What is the InChIKey of 2,2,3,4-tetramethylhex-3-ene?
The InChIKey is BZZNMKJWBUUWTN-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H20/c1-7-8(2)9(3)10(4,5)6/h7H2,1-6H3.
What are the key properties of 2,2,3,4-tetramethylhex-3-ene?
2,2,3,4-tetramethylhex-3-ene has a molecular weight of 140.27 g/mol, XLogP of 3.78, 1 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for 2,2,3,4-tetramethylhex-3-ene is sourced from PubChem (CID 59938599), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).