8,9-dimethyl-4-propan-2-ylundec-5-ene

C16H32 — CID 123486023

IUPAC8,9-dimethyl-4-propan-2-ylundec-5-ene
SMILESCCCC(C=CCC(C)C(C)CC)C(C)C
InChIInChI=1S/C16H32/c1-7-10-16(13(3)4)12-9-11-15(6)14(5)8-2/h9,12-16H,7-8,10-11H2,1-6H3
InChIKeyGFSOLNSCYWUODY-UHFFFAOYSA-N
MW224.43 g/mol
LogP5.69
Rot. Bonds8

About 8,9-dimethyl-4-propan-2-ylundec-5-ene

8,9-dimethyl-4-propan-2-ylundec-5-ene (PubChem CID 123486023) has the molecular formula C16H32 and a molecular weight of 224.43 g/mol. Its IUPAC name is 8,9-dimethyl-4-propan-2-ylundec-5-ene.

Molecular Properties

Compound Name8,9-dimethyl-4-propan-2-ylundec-5-ene
PubChem CID123486023
Molecular FormulaC16H32
Molecular Weight224.43 g/mol
Exact Mass224.25
IUPAC Name8,9-dimethyl-4-propan-2-ylundec-5-ene
SMILESCCCC(C=CCC(C)C(C)CC)C(C)C
InChIInChI=1S/C16H32/c1-7-10-16(13(3)4)12-9-11-15(6)14(5)8-2/h9,12-16H,7-8,10-11H2,1-6H3
InChIKeyGFSOLNSCYWUODY-UHFFFAOYSA-N
XLogP5.69
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds8
Heavy Atoms16
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500224.43
LogP ≤ 55.69
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-propan-2-ylhept-2-ene
CID 54114231
10-ethenyl-3,8-dimethyl-4-propyltridec-5-ene
CID 173342665
methane;(E,4R)-4-propan-2-ylhept-2-ene
CID 158370601
3,7,8-trimethylnon-4-ene
CID 91465939
(3R)-3,4-dimethylheptane
CID 59819300
8-methyl-5-propan-2-ylnon-3-ene
CID 123416955
(E,5R,6R)-1,1,1-trifluoro-5,6-dimethyloct-2-ene
CID 174009478
5-ethyl-6-methyloct-3-ene
CID 90715471
(E)-1-ethoxy-4-ethyl-5-methylhex-2-ene
CID 177330593
(E,6S)-2,6,7-trimethyloct-3-ene
CID 161076844
(4S)-3-methyl-4-propan-2-ylheptane
CID 59076556
(E)-7,8-dimethyldec-3-ene
CID 164805816

Frequently Asked Questions

What is the IUPAC name of 8,9-dimethyl-4-propan-2-ylundec-5-ene?
The IUPAC name of 8,9-dimethyl-4-propan-2-ylundec-5-ene (CID 123486023) is 8,9-dimethyl-4-propan-2-ylundec-5-ene.
What is the SMILES notation for 8,9-dimethyl-4-propan-2-ylundec-5-ene?
The canonical SMILES for 8,9-dimethyl-4-propan-2-ylundec-5-ene is CCCC(C=CCC(C)C(C)CC)C(C)C.
What is the InChIKey of 8,9-dimethyl-4-propan-2-ylundec-5-ene?
The InChIKey is GFSOLNSCYWUODY-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H32/c1-7-10-16(13(3)4)12-9-11-15(6)14(5)8-2/h9,12-16H,7-8,10-11H2,1-6H3.
What are the key properties of 8,9-dimethyl-4-propan-2-ylundec-5-ene?
8,9-dimethyl-4-propan-2-ylundec-5-ene has a molecular weight of 224.43 g/mol, XLogP of 5.69, 8 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for 8,9-dimethyl-4-propan-2-ylundec-5-ene is sourced from PubChem (CID 123486023), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).