(3Z)-5-ethyl-6-methylhepta-1,3,5-triene

C10H16 — CID 143033929

IUPAC(3Z)-5-ethyl-6-methylhepta-1,3,5-triene
SMILESC=C/C=C\C(CC)=C(C)C
InChIInChI=1S/C10H16/c1-5-7-8-10(6-2)9(3)4/h5,7-8H,1,6H2,2-4H3/b8-7-
InChIKeyNUQSEBJELSWBNR-FPLPWBNLSA-N
MW136.24 g/mol
LogP3.47
Rot. Bonds3

About (3Z)-5-ethyl-6-methylhepta-1,3,5-triene

(3Z)-5-ethyl-6-methylhepta-1,3,5-triene (PubChem CID 143033929) has the molecular formula C10H16 and a molecular weight of 136.24 g/mol. Its IUPAC name is (3Z)-5-ethyl-6-methylhepta-1,3,5-triene.

Molecular Properties

Compound Name(3Z)-5-ethyl-6-methylhepta-1,3,5-triene
PubChem CID143033929
Molecular FormulaC10H16
Molecular Weight136.24 g/mol
Exact Mass136.13
IUPAC Name(3Z)-5-ethyl-6-methylhepta-1,3,5-triene
SMILESC=C/C=C\C(CC)=C(C)C
InChIInChI=1S/C10H16/c1-5-7-8-10(6-2)9(3)4/h5,7-8H,1,6H2,2-4H3/b8-7-
InChIKeyNUQSEBJELSWBNR-FPLPWBNLSA-N
XLogP3.47
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds3
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500136.24
LogP ≤ 53.47
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

Computed Properties (RDKit)

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

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Related Compounds

(3Z,5Z)-3,4-diethylocta-1,3,5,7-tetraene;ethane
CID 162432866
ethane;(3Z,5E)-5-ethyl-6-methylnona-1,3,5-triene
CID 144652026
(3Z,5Z)-5-methylhepta-1,3,5-triene;propane
CID 142516353
5-methylocta-1,3,5-triene
CID 123706098
ethane;(3Z,5Z)-5-ethylhepta-1,3,5-triene
CID 145142585
(3Z,5Z)-4-ethylocta-1,3,5,7-tetraene
CID 142047079
(3Z,5Z)-5-ethylhepta-1,3,5-triene;methane
CID 143680457
(3Z,5Z)-5-ethylhepta-1,3,5-triene;2-methylbuta-1,3-diene
CID 162361818
(1Z,3Z)-N-ethyl-2-methylhexa-1,3,5-trien-1-amine
CID 126710731
ethane;(Z)-[(4Z)-hepta-4,6-dien-3-ylidene]hydrazine
CID 165132847
[(3Z)-hexa-1,3,5-trien-2-yl] N-ethylethanimidate
CID 130278986
(3Z)-7-methyl-5-methylideneocta-1,3,7-triene
CID 142221683

Frequently Asked Questions

What is the IUPAC name of (3Z)-5-ethyl-6-methylhepta-1,3,5-triene?
The IUPAC name of (3Z)-5-ethyl-6-methylhepta-1,3,5-triene (CID 143033929) is (3Z)-5-ethyl-6-methylhepta-1,3,5-triene.
What is the SMILES notation for (3Z)-5-ethyl-6-methylhepta-1,3,5-triene?
The canonical SMILES for (3Z)-5-ethyl-6-methylhepta-1,3,5-triene is C=C/C=C\C(CC)=C(C)C.
What is the InChIKey of (3Z)-5-ethyl-6-methylhepta-1,3,5-triene?
The InChIKey is NUQSEBJELSWBNR-FPLPWBNLSA-N. The full InChI is InChI=1S/C10H16/c1-5-7-8-10(6-2)9(3)4/h5,7-8H,1,6H2,2-4H3/b8-7-.
What are the key properties of (3Z)-5-ethyl-6-methylhepta-1,3,5-triene?
(3Z)-5-ethyl-6-methylhepta-1,3,5-triene has a molecular weight of 136.24 g/mol, XLogP of 3.47, 3 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for (3Z)-5-ethyl-6-methylhepta-1,3,5-triene is sourced from PubChem (CID 143033929), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).