(3E,16E)-nonadeca-3,16-diene

C19H36 — CID 157471321

IUPAC(3E,16E)-nonadeca-3,16-diene
SMILESCC/C=C/CCCCCCCCCCC/C=C/CC
InChIInChI=1S/C19H36/c1-3-5-7-9-11-13-15-17-19-18-16-14-12-10-8-6-4-2/h5-8H,3-4,9-19H2,1-2H3/b7-5+,8-6+
InChIKeyBVBNJWDFABIDHJ-KQQUZDAGSA-N
MW264.50 g/mol
LogP7.21
Rot. Bonds14

About (3E,16E)-nonadeca-3,16-diene

(3E,16E)-nonadeca-3,16-diene (PubChem CID 157471321) has the molecular formula C19H36 and a molecular weight of 264.50 g/mol. Its IUPAC name is (3E,16E)-nonadeca-3,16-diene.

Molecular Properties

Compound Name(3E,16E)-nonadeca-3,16-diene
PubChem CID157471321
Molecular FormulaC19H36
Molecular Weight264.50 g/mol
Exact Mass264.28
IUPAC Name(3E,16E)-nonadeca-3,16-diene
SMILESCC/C=C/CCCCCCCCCCC/C=C/CC
InChIInChI=1S/C19H36/c1-3-5-7-9-11-13-15-17-19-18-16-14-12-10-8-6-4-2/h5-8H,3-4,9-19H2,1-2H3/b7-5+,8-6+
InChIKeyBVBNJWDFABIDHJ-KQQUZDAGSA-N
XLogP7.21
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds14
Heavy Atoms19
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500264.50
LogP ≤ 57.21
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)-nonacos-3-ene
CID 22172230
(3Z,11Z)-heptadeca-3,11-diene
CID 91750518
octacos-3-ene
CID 54171253
(Z)-tridec-3-ene
CID 5362711
(E)-octadec-3-ene
CID 5365984
(E)-heptadec-3-ene
CID 5352250
(3E,13E)-nonadeca-3,13-diene
CID 141029609
(E)-non-3-ene
CID 5364445
tridec-10-en-1-ol
CID 53427401
pentadec-12-en-1-amine
CID 174557378
trideca-1,10-diene
CID 54351837
(E)-12-bromododec-3-ene
CID 20561604

Frequently Asked Questions

What is the IUPAC name of (3E,16E)-nonadeca-3,16-diene?
The IUPAC name of (3E,16E)-nonadeca-3,16-diene (CID 157471321) is (3E,16E)-nonadeca-3,16-diene.
What is the SMILES notation for (3E,16E)-nonadeca-3,16-diene?
The canonical SMILES for (3E,16E)-nonadeca-3,16-diene is CC/C=C/CCCCCCCCCCC/C=C/CC.
What is the InChIKey of (3E,16E)-nonadeca-3,16-diene?
The InChIKey is BVBNJWDFABIDHJ-KQQUZDAGSA-N. The full InChI is InChI=1S/C19H36/c1-3-5-7-9-11-13-15-17-19-18-16-14-12-10-8-6-4-2/h5-8H,3-4,9-19H2,1-2H3/b7-5+,8-6+.
What are the key properties of (3E,16E)-nonadeca-3,16-diene?
(3E,16E)-nonadeca-3,16-diene has a molecular weight of 264.50 g/mol, XLogP of 7.21, 14 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for (3E,16E)-nonadeca-3,16-diene is sourced from PubChem (CID 157471321), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).