(E)-3-iodo-1-methoxynon-2-ene

C10H19IO — CID 10493117

IUPAC(E)-3-iodo-1-methoxynon-2-ene
SMILESCCCCCC/C(I)=C\COC
InChIInChI=1S/C10H19IO/c1-3-4-5-6-7-10(11)8-9-12-2/h8H,3-7,9H2,1-2H3/b10-8+
InChIKeyUSBGIKBJUSZJPQ-CSKARUKUSA-N
MW282.16 g/mol
LogP3.92
Rot. Bonds7

About (E)-3-iodo-1-methoxynon-2-ene

(E)-3-iodo-1-methoxynon-2-ene (PubChem CID 10493117) has the molecular formula C10H19IO and a molecular weight of 282.16 g/mol. Its IUPAC name is (E)-3-iodo-1-methoxynon-2-ene.

Molecular Properties

Compound Name(E)-3-iodo-1-methoxynon-2-ene
PubChem CID10493117
Molecular FormulaC10H19IO
Molecular Weight282.16 g/mol
Exact Mass282.05
IUPAC Name(E)-3-iodo-1-methoxynon-2-ene
SMILESCCCCCC/C(I)=C\COC
InChIInChI=1S/C10H19IO/c1-3-4-5-6-7-10(11)8-9-12-2/h8H,3-7,9H2,1-2H3/b10-8+
InChIKeyUSBGIKBJUSZJPQ-CSKARUKUSA-N
XLogP3.92
TPSA9.23 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds7
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500282.16
LogP ≤ 53.92
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

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

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Related Compounds

(E)-1,2-diiododec-1-ene
CID 11361339
(E)-1,2-diiodohept-1-ene
CID 15312157
2-iodooct-1-enyl(trimethyl)silane
CID 71353850
methyl (Z)-3-iodooct-2-enoate
CID 6421671
(E)-1,2-dibromohept-1-ene
CID 134985754
(13E,15E)-13,16-dibromooctacosa-13,15-diene
CID 101467578
10-icos-9-en-10-yloxyicos-9-ene
CID 57044989
1,1,1-trifluoro-3-iodooct-2-ene
CID 72824718
(Z)-3-bromooct-2-ene
CID 13181431
methyl 3-iodohept-2-enoate
CID 71346581
(E)-1-methoxytridec-2-ene
CID 13441703
(Z)-1-methoxynon-2-ene
CID 12563927

Frequently Asked Questions

What is the IUPAC name of (E)-3-iodo-1-methoxynon-2-ene?
The IUPAC name of (E)-3-iodo-1-methoxynon-2-ene (CID 10493117) is (E)-3-iodo-1-methoxynon-2-ene.
What is the SMILES notation for (E)-3-iodo-1-methoxynon-2-ene?
The canonical SMILES for (E)-3-iodo-1-methoxynon-2-ene is CCCCCC/C(I)=C\COC.
What is the InChIKey of (E)-3-iodo-1-methoxynon-2-ene?
The InChIKey is USBGIKBJUSZJPQ-CSKARUKUSA-N. The full InChI is InChI=1S/C10H19IO/c1-3-4-5-6-7-10(11)8-9-12-2/h8H,3-7,9H2,1-2H3/b10-8+.
What are the key properties of (E)-3-iodo-1-methoxynon-2-ene?
(E)-3-iodo-1-methoxynon-2-ene has a molecular weight of 282.16 g/mol, XLogP of 3.92, 7 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for (E)-3-iodo-1-methoxynon-2-ene is sourced from PubChem (CID 10493117), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).