(4-iodo-3-methylbut-2-en-2-yl)silane

C5H11ISi — CID 173207035

IUPAC(4-iodo-3-methylbut-2-en-2-yl)silane
SMILESCC([SiH3])=C(C)CI
InChIInChI=1S/C5H11ISi/c1-4(3-6)5(2)7/h3H2,1-2,7H3
InChIKeyCNBNKSVRQRDTMW-UHFFFAOYSA-N
MW226.13 g/mol
LogP1.08
Rot. Bonds1

About (4-iodo-3-methylbut-2-en-2-yl)silane

(4-iodo-3-methylbut-2-en-2-yl)silane (PubChem CID 173207035) has the molecular formula C5H11ISi and a molecular weight of 226.13 g/mol. Its IUPAC name is (4-iodo-3-methylbut-2-en-2-yl)silane.

Molecular Properties

Compound Name(4-iodo-3-methylbut-2-en-2-yl)silane
PubChem CID173207035
Molecular FormulaC5H11ISi
Molecular Weight226.13 g/mol
Exact Mass225.97
IUPAC Name(4-iodo-3-methylbut-2-en-2-yl)silane
SMILESCC([SiH3])=C(C)CI
InChIInChI=1S/C5H11ISi/c1-4(3-6)5(2)7/h3H2,1-2,7H3
InChIKeyCNBNKSVRQRDTMW-UHFFFAOYSA-N
XLogP1.08
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds1
Heavy Atoms7
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500226.13
LogP ≤ 51.08
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

Computed Properties (RDKit)

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

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Related Compounds

N,N-dibutyl-2-methyl-3-silylbut-2-en-1-amine
CID 173111934
(6-chloro-3-methylhex-2-en-2-yl)silane
CID 173021512
3-fluorobut-2-en-2-ylsilane
CID 173098765
(E)-1-chloro-3-iodo-2-methylprop-1-ene
CID 122235667
1-[diacetyl(iodomethyl)silyl]ethanone
CID 89427608
iodoethane;methanol
CID 91561254
3-(2,3,4,5,6-pentamethylphenyl)but-2-en-2-ylsilane
CID 150318412
1-chloro-2-(iodomethyl)-3-methylbut-2-ene
CID 88877933
2,3-bis(iodomethyl)-4-methylpenta-1,3-diene
CID 155659813
N'-ethyl-N-[(E)-1,1,1-trifluoro-4-iodo-3-methylbut-2-en-2-yl]methanimidamide
CID 90084225
3,4-dimethylpenta-2,4-dien-2-ylsilane
CID 154334462
iodo(1,2-13C2)ethane
CID 10855737

Frequently Asked Questions

What is the IUPAC name of (4-iodo-3-methylbut-2-en-2-yl)silane?
The IUPAC name of (4-iodo-3-methylbut-2-en-2-yl)silane (CID 173207035) is (4-iodo-3-methylbut-2-en-2-yl)silane.
What is the SMILES notation for (4-iodo-3-methylbut-2-en-2-yl)silane?
The canonical SMILES for (4-iodo-3-methylbut-2-en-2-yl)silane is CC([SiH3])=C(C)CI.
What is the InChIKey of (4-iodo-3-methylbut-2-en-2-yl)silane?
The InChIKey is CNBNKSVRQRDTMW-UHFFFAOYSA-N. The full InChI is InChI=1S/C5H11ISi/c1-4(3-6)5(2)7/h3H2,1-2,7H3.
What are the key properties of (4-iodo-3-methylbut-2-en-2-yl)silane?
(4-iodo-3-methylbut-2-en-2-yl)silane has a molecular weight of 226.13 g/mol, XLogP of 1.08, 1 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for (4-iodo-3-methylbut-2-en-2-yl)silane is sourced from PubChem (CID 173207035), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).