(Z)-2,15-dimethylhexadec-8-ene

C18H36 — CID 176630952

IUPAC(Z)-2,15-dimethylhexadec-8-ene
SMILESCC(C)CCCCC/C=C\CCCCCC(C)C
InChIInChI=1S/C18H36/c1-17(2)15-13-11-9-7-5-6-8-10-12-14-16-18(3)4/h5-6,17-18H,7-16H2,1-4H3/b6-5-
InChIKeyKWTWTLMEWDDZEE-WAYWQWQTSA-N
MW252.49 g/mol
LogP6.76
Rot. Bonds12

About (Z)-2,15-dimethylhexadec-8-ene

(Z)-2,15-dimethylhexadec-8-ene (PubChem CID 176630952) has the molecular formula C18H36 and a molecular weight of 252.49 g/mol. Its IUPAC name is (Z)-2,15-dimethylhexadec-8-ene.

Molecular Properties

Compound Name(Z)-2,15-dimethylhexadec-8-ene
PubChem CID176630952
Molecular FormulaC18H36
Molecular Weight252.49 g/mol
Exact Mass252.28
IUPAC Name(Z)-2,15-dimethylhexadec-8-ene
SMILESCC(C)CCCCC/C=C\CCCCCC(C)C
InChIInChI=1S/C18H36/c1-17(2)15-13-11-9-7-5-6-8-10-12-14-16-18(3)4/h5-6,17-18H,7-16H2,1-4H3/b6-5-
InChIKeyKWTWTLMEWDDZEE-WAYWQWQTSA-N
XLogP6.76
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds12
Heavy Atoms18
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500252.49
LogP ≤ 56.76
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

(E)-2,15-dimethylhexadec-8-ene
CID 176630932
(Z)-2,16-dimethylheptadec-6-ene
CID 176630987
(Z)-2,11-dimethyldodec-6-ene;(E)-2,11-dimethyldodec-6-ene;(Z)-2,14-dimethylpentadec-6-ene;(E)-2,14-dimethylpentadec-6-ene
CID 161032897
(E)-2,16-dimethylheptadec-6-ene
CID 176630989
(E)-2,13-dimethyltetradec-7-ene
CID 176630990
(E)-2,12-dimethyltridec-6-ene
CID 176630963
(E)-2,11-dimethyldodec-5-ene
CID 168834978
2-methylhenicos-9-ene
CID 54211724
(E)-2-methylheptadec-7-ene
CID 173124832
(Z)-22-methyltricos-9-ene
CID 152752766
(E)-2-methylheptadec-8-ene
CID 20541049
10-methylundec-3-ene
CID 544769

Frequently Asked Questions

What is the IUPAC name of (Z)-2,15-dimethylhexadec-8-ene?
The IUPAC name of (Z)-2,15-dimethylhexadec-8-ene (CID 176630952) is (Z)-2,15-dimethylhexadec-8-ene.
What is the SMILES notation for (Z)-2,15-dimethylhexadec-8-ene?
The canonical SMILES for (Z)-2,15-dimethylhexadec-8-ene is CC(C)CCCCC/C=C\CCCCCC(C)C.
What is the InChIKey of (Z)-2,15-dimethylhexadec-8-ene?
The InChIKey is KWTWTLMEWDDZEE-WAYWQWQTSA-N. The full InChI is InChI=1S/C18H36/c1-17(2)15-13-11-9-7-5-6-8-10-12-14-16-18(3)4/h5-6,17-18H,7-16H2,1-4H3/b6-5-.
What are the key properties of (Z)-2,15-dimethylhexadec-8-ene?
(Z)-2,15-dimethylhexadec-8-ene has a molecular weight of 252.49 g/mol, XLogP of 6.76, 12 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for (Z)-2,15-dimethylhexadec-8-ene is sourced from PubChem (CID 176630952), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).