1-iodo-2-methylprop-1-ene

C4H7I — CID 11041348

IUPAC1-iodo-2-methylprop-1-ene
SMILESCC(C)=CI
InChIInChI=1S/C4H7I/c1-4(2)3-5/h3H,1-2H3
InChIKeyINLKHEAPNAVZAJ-UHFFFAOYSA-N
MW182.00 g/mol
LogP2.35
Rot. Bonds

About 1-iodo-2-methylprop-1-ene

1-iodo-2-methylprop-1-ene (PubChem CID 11041348) has the molecular formula C4H7I and a molecular weight of 182.00 g/mol. Its IUPAC name is 1-iodo-2-methylprop-1-ene.

Molecular Properties

Compound Name1-iodo-2-methylprop-1-ene
PubChem CID11041348
Molecular FormulaC4H7I
Molecular Weight182.00 g/mol
Exact Mass181.96
IUPAC Name1-iodo-2-methylprop-1-ene
SMILESCC(C)=CI
InChIInChI=1S/C4H7I/c1-4(2)3-5/h3H,1-2H3
InChIKeyINLKHEAPNAVZAJ-UHFFFAOYSA-N
XLogP2.35
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds
Heavy Atoms5
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500182.00
LogP ≤ 52.35
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

Computed Properties (RDKit)

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

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Related Compounds

4-Iodo-2-methylbut-1-ene
CID 10262076
3-Iodo-2-methylprop-1-ene
CID 10877752
3-Iodo-2-(iodomethyl)prop-1-ene
CID 11045029
1-Iodo-3-methyl-2-butene
CID 11333045
cis-1-Iodo-2-methyl-1-butene
CID 44238476
(2E)-1-Iodo-2-methyl-2-butene
CID 11954630
trans-1-Iodo-2-methyl-1-butene
CID 19792910
4-Iodo-2-methylbut-1-en-3-yne
CID 12735461
1,3-Diiodo-2-methylprop-1-ene
CID 117778436
3-Iodo-2-ethyl-1-propene
CID 10932362
3-Iodo-2-methyl-1-butene
CID 21255799
3-Fluoro-3,3-diiodo-2-methylprop-1-ene
CID 117789838

Frequently Asked Questions

What is the IUPAC name of 1-iodo-2-methylprop-1-ene?
The IUPAC name of 1-iodo-2-methylprop-1-ene (CID 11041348) is 1-iodo-2-methylprop-1-ene.
What is the SMILES notation for 1-iodo-2-methylprop-1-ene?
The canonical SMILES for 1-iodo-2-methylprop-1-ene is CC(C)=CI.
What is the InChIKey of 1-iodo-2-methylprop-1-ene?
The InChIKey is INLKHEAPNAVZAJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C4H7I/c1-4(2)3-5/h3H,1-2H3.
What are the key properties of 1-iodo-2-methylprop-1-ene?
1-iodo-2-methylprop-1-ene has a molecular weight of 182.00 g/mol, XLogP of 2.35, 0 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for 1-iodo-2-methylprop-1-ene is sourced from PubChem (CID 11041348), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).