(7E)-4-methylnona-1,7-diene

C10H18 — CID 173060914

IUPAC(7E)-4-methylnona-1,7-diene
SMILESC=CCC(C)CC/C=C/C
InChIInChI=1S/C10H18/c1-4-6-7-9-10(3)8-5-2/h4-6,10H,2,7-9H2,1,3H3/b6-4+
InChIKeyKCJYICSSXHRCND-GQCTYLIASA-N
MW138.25 g/mol
LogP3.55
Rot. Bonds5

About (7E)-4-methylnona-1,7-diene

(7E)-4-methylnona-1,7-diene (PubChem CID 173060914) has the molecular formula C10H18 and a molecular weight of 138.25 g/mol. Its IUPAC name is (7E)-4-methylnona-1,7-diene.

Molecular Properties

Compound Name(7E)-4-methylnona-1,7-diene
PubChem CID173060914
Molecular FormulaC10H18
Molecular Weight138.25 g/mol
Exact Mass138.14
IUPAC Name(7E)-4-methylnona-1,7-diene
SMILESC=CCC(C)CC/C=C/C
InChIInChI=1S/C10H18/c1-4-6-7-9-10(3)8-5-2/h4-6,10H,2,7-9H2,1,3H3/b6-4+
InChIKeyKCJYICSSXHRCND-GQCTYLIASA-N
XLogP3.55
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds5
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500138.25
LogP ≤ 53.55
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

Computed Properties (RDKit)

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

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Related Compounds

ethane;4-methylocta-1,7-diene
CID 144616064
(6E)-3-methylocta-1,6-diene
CID 14140905
6-methylnon-2-ene
CID 21361194
4-methyl-6-sulfinosulfanylundeca-1,9-diene
CID 163171824
(E)-3-methyloct-6-en-1-ol
CID 14091580
4-bromodeca-1,8-diene
CID 150882644
trichloro(3-methylhex-5-enyl)silane
CID 175442366
(2E)-2-ethylidene-5-methyloct-7-en-1-amine
CID 89126708
4-methyldodeca-1,6,8,10-tetraene
CID 123717396
tetrakis(pent-3-enyl)phosphanium
CID 154314281
hept-5-en-2-amine
CID 72784707
6,7-dimethyloct-2-ene
CID 54205493

Frequently Asked Questions

What is the IUPAC name of (7E)-4-methylnona-1,7-diene?
The IUPAC name of (7E)-4-methylnona-1,7-diene (CID 173060914) is (7E)-4-methylnona-1,7-diene.
What is the SMILES notation for (7E)-4-methylnona-1,7-diene?
The canonical SMILES for (7E)-4-methylnona-1,7-diene is C=CCC(C)CC/C=C/C.
What is the InChIKey of (7E)-4-methylnona-1,7-diene?
The InChIKey is KCJYICSSXHRCND-GQCTYLIASA-N. The full InChI is InChI=1S/C10H18/c1-4-6-7-9-10(3)8-5-2/h4-6,10H,2,7-9H2,1,3H3/b6-4+.
What are the key properties of (7E)-4-methylnona-1,7-diene?
(7E)-4-methylnona-1,7-diene has a molecular weight of 138.25 g/mol, XLogP of 3.55, 5 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for (7E)-4-methylnona-1,7-diene is sourced from PubChem (CID 173060914), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).