undec-10-en-2-ylbenzene

C17H26 — CID 140694797

IUPACundec-10-en-2-ylbenzene
SMILESC=CCCCCCCCC(C)c1ccccc1
InChIInChI=1S/C17H26/c1-3-4-5-6-7-8-10-13-16(2)17-14-11-9-12-15-17/h3,9,11-12,14-16H,1,4-8,10,13H2,2H3
InChIKeyMUYKULPTCFTMLG-UHFFFAOYSA-N
MW230.40 g/mol
LogP5.71
Rot. Bonds9

About undec-10-en-2-ylbenzene

undec-10-en-2-ylbenzene (PubChem CID 140694797) has the molecular formula C17H26 and a molecular weight of 230.40 g/mol. Its IUPAC name is undec-10-en-2-ylbenzene.

Molecular Properties

Compound Nameundec-10-en-2-ylbenzene
PubChem CID140694797
Molecular FormulaC17H26
Molecular Weight230.40 g/mol
Exact Mass230.20
IUPAC Nameundec-10-en-2-ylbenzene
SMILESC=CCCCCCCCC(C)c1ccccc1
InChIInChI=1S/C17H26/c1-3-4-5-6-7-8-10-13-16(2)17-14-11-9-12-15-17/h3,9,11-12,14-16H,1,4-8,10,13H2,2H3
InChIKeyMUYKULPTCFTMLG-UHFFFAOYSA-N
XLogP5.71
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds9
Heavy Atoms17
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500230.40
LogP ≤ 55.71
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

Computed Properties (RDKit)

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

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Related Compounds

tridec-12-en-2-ylbenzene
CID 140694820
2-methyl-1-phenylnon-8-en-1-ol
CID 107010040
tetradec-13-en-7-ylbenzene
CID 140694824
1-oct-7-en-2-yl-4-(trifluoromethyl)benzene
CID 134981740
2-phenyldec-9-en-1-amine
CID 107010668
2,14-diphenylpentadecan-8-ol
CID 71175182
(1-ethyl-9-phenyldecyl)benzene
CID 154659486
6-phenylhexan-2-ylbenzene
CID 19704587
triphenyl(undec-10-enyl)phosphanium
CID 3716115
N-(5-phenylhexyl)hexan-1-imine
CID 91399547
5-chloropentan-2-ylbenzene
CID 524354
tert-butyl-diphenyl-[(2S)-undec-10-en-2-yl]oxysilane
CID 11988597

Frequently Asked Questions

What is the IUPAC name of undec-10-en-2-ylbenzene?
The IUPAC name of undec-10-en-2-ylbenzene (CID 140694797) is undec-10-en-2-ylbenzene.
What is the SMILES notation for undec-10-en-2-ylbenzene?
The canonical SMILES for undec-10-en-2-ylbenzene is C=CCCCCCCCC(C)c1ccccc1.
What is the InChIKey of undec-10-en-2-ylbenzene?
The InChIKey is MUYKULPTCFTMLG-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H26/c1-3-4-5-6-7-8-10-13-16(2)17-14-11-9-12-15-17/h3,9,11-12,14-16H,1,4-8,10,13H2,2H3.
What are the key properties of undec-10-en-2-ylbenzene?
undec-10-en-2-ylbenzene has a molecular weight of 230.40 g/mol, XLogP of 5.71, 9 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for undec-10-en-2-ylbenzene is sourced from PubChem (CID 140694797), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).