1-dec-1-en-2-yl-4-methylbenzene

C17H26 — CID 3805374

IUPAC1-dec-1-en-2-yl-4-methylbenzene
SMILESC=C(CCCCCCCC)c1ccc(C)cc1
InChIInChI=1S/C17H26/c1-4-5-6-7-8-9-10-16(3)17-13-11-15(2)12-14-17/h11-14H,3-10H2,1-2H3
InChIKeyHJBGFIKOCXCMBS-UHFFFAOYSA-N
MW230.40 g/mol
LogP5.76
Rot. Bonds8

About 1-dec-1-en-2-yl-4-methylbenzene

1-dec-1-en-2-yl-4-methylbenzene (PubChem CID 3805374) has the molecular formula C17H26 and a molecular weight of 230.40 g/mol. Its IUPAC name is 1-dec-1-en-2-yl-4-methylbenzene.

Molecular Properties

Compound Name1-dec-1-en-2-yl-4-methylbenzene
PubChem CID3805374
Molecular FormulaC17H26
Molecular Weight230.40 g/mol
Exact Mass230.20
IUPAC Name1-dec-1-en-2-yl-4-methylbenzene
SMILESC=C(CCCCCCCC)c1ccc(C)cc1
InChIInChI=1S/C17H26/c1-4-5-6-7-8-9-10-16(3)17-13-11-15(2)12-14-17/h11-14H,3-10H2,1-2H3
InChIKeyHJBGFIKOCXCMBS-UHFFFAOYSA-N
XLogP5.76
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds8
Heavy Atoms17
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500230.40
LogP ≤ 55.76
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

Computed Properties (RDKit)

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

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Related Compounds

1-methyl-4-[7-(4-methylphenyl)octa-1,7-dien-2-yl]benzene
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1-methyl-4-(7-methylocta-1,7-dien-2-yl)benzene
CID 143865907
4-tetracos-1-en-2-ylpyridine
CID 69120272
1-methyl-3-oct-1-en-2-ylbenzene
CID 102357647
2,5-dimethylhex-1-ene;ethane;1-hex-1-en-2-yl-4-methylbenzene
CID 143117352
1-hex-1-en-2-yl-4-propylbenzene
CID 22166244
formaldehyde;hexane;1,4-xylene
CID 143308406
CID 101317933
CID 101317933
1-methyl-4-(8-phenyloct-1-en-7-yn-2-yl)benzene
CID 166448261
hexanoic acid;1,4-xylene
CID 23205671
4-methyl-N'-octanoylbenzohydrazide
CID 4958769
1-[(E)-1-bromoundec-3-en-4-yl]-4-methylbenzene
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Frequently Asked Questions

What is the IUPAC name of 1-dec-1-en-2-yl-4-methylbenzene?
The IUPAC name of 1-dec-1-en-2-yl-4-methylbenzene (CID 3805374) is 1-dec-1-en-2-yl-4-methylbenzene.
What is the SMILES notation for 1-dec-1-en-2-yl-4-methylbenzene?
The canonical SMILES for 1-dec-1-en-2-yl-4-methylbenzene is C=C(CCCCCCCC)c1ccc(C)cc1.
What is the InChIKey of 1-dec-1-en-2-yl-4-methylbenzene?
The InChIKey is HJBGFIKOCXCMBS-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H26/c1-4-5-6-7-8-9-10-16(3)17-13-11-15(2)12-14-17/h11-14H,3-10H2,1-2H3.
What are the key properties of 1-dec-1-en-2-yl-4-methylbenzene?
1-dec-1-en-2-yl-4-methylbenzene has a molecular weight of 230.40 g/mol, XLogP of 5.76, 8 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for 1-dec-1-en-2-yl-4-methylbenzene is sourced from PubChem (CID 3805374), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).