(5E)-5-methyl-3,4-dimethylidenehepta-1,5-diene

C10H14 — CID 144801201

IUPAC(5E)-5-methyl-3,4-dimethylidenehepta-1,5-diene
SMILESC=CC(=C)C(=C)/C(C)=C/C
InChIInChI=1S/C10H14/c1-6-8(3)10(5)9(4)7-2/h6-7H,1,3,5H2,2,4H3/b9-7+
InChIKeyPASWUTMKLCLNCS-VQHVLOKHSA-N
MW134.22 g/mol
LogP3.25
Rot. Bonds3

About (5E)-5-methyl-3,4-dimethylidenehepta-1,5-diene

(5E)-5-methyl-3,4-dimethylidenehepta-1,5-diene (PubChem CID 144801201) has the molecular formula C10H14 and a molecular weight of 134.22 g/mol. Its IUPAC name is (5E)-5-methyl-3,4-dimethylidenehepta-1,5-diene.

Molecular Properties

Compound Name(5E)-5-methyl-3,4-dimethylidenehepta-1,5-diene
PubChem CID144801201
Molecular FormulaC10H14
Molecular Weight134.22 g/mol
Exact Mass134.11
IUPAC Name(5E)-5-methyl-3,4-dimethylidenehepta-1,5-diene
SMILESC=CC(=C)C(=C)/C(C)=C/C
InChIInChI=1S/C10H14/c1-6-8(3)10(5)9(4)7-2/h6-7H,1,3,5H2,2,4H3/b9-7+
InChIKeyPASWUTMKLCLNCS-VQHVLOKHSA-N
XLogP3.25
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds3
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500134.22
LogP ≤ 53.25
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

5-ethyl-3,4-dimethylidenehepta-1,5-diene
CID 91458758
(4E,5E)-5-bromo-4-ethylidene-3-methylidenehepta-1,5-diene
CID 156799565
ethane;(3Z,6E)-6-methyl-5-methylideneocta-1,3,6-triene
CID 145268478
(5Z)-3,4-dimethylidenehepta-1,5-diene;ethane
CID 143166172
(5Z)-3,4-dimethylidenehepta-1,5-diene;ethane
CID 145140668
(3Z,6Z)-2,6-dimethyl-5-methylideneocta-1,3,6-triene
CID 166131805
(3Z)-2-bromo-3-methylpenta-1,3-diene;ethene
CID 144646634
(2E,5Z)-5-methyl-4-methylidenehepta-2,5-dien-2-amine
CID 169247779
(2E)-2-ethylidene-3-methylidenepent-4-enal
CID 123838343
2-methylbuta-1,3-diene;2-methylbut-1-ene
CID 160626231
(E)-2-fluorobut-2-ene;2-methylbuta-1,3-diene
CID 142535063
3-methylpent-3-en-2-ylidenetungsten
CID 23389049

Frequently Asked Questions

What is the IUPAC name of (5E)-5-methyl-3,4-dimethylidenehepta-1,5-diene?
The IUPAC name of (5E)-5-methyl-3,4-dimethylidenehepta-1,5-diene (CID 144801201) is (5E)-5-methyl-3,4-dimethylidenehepta-1,5-diene.
What is the SMILES notation for (5E)-5-methyl-3,4-dimethylidenehepta-1,5-diene?
The canonical SMILES for (5E)-5-methyl-3,4-dimethylidenehepta-1,5-diene is C=CC(=C)C(=C)/C(C)=C/C.
What is the InChIKey of (5E)-5-methyl-3,4-dimethylidenehepta-1,5-diene?
The InChIKey is PASWUTMKLCLNCS-VQHVLOKHSA-N. The full InChI is InChI=1S/C10H14/c1-6-8(3)10(5)9(4)7-2/h6-7H,1,3,5H2,2,4H3/b9-7+.
What are the key properties of (5E)-5-methyl-3,4-dimethylidenehepta-1,5-diene?
(5E)-5-methyl-3,4-dimethylidenehepta-1,5-diene has a molecular weight of 134.22 g/mol, XLogP of 3.25, 3 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for (5E)-5-methyl-3,4-dimethylidenehepta-1,5-diene is sourced from PubChem (CID 144801201), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).