(3-methylcyclohexa-1,3-dien-1-yl)silane

C7H12Si — CID 173485389

IUPAC(3-methylcyclohexa-1,3-dien-1-yl)silane
SMILESCC1=CCCC([SiH3])=C1
InChIInChI=1S/C7H12Si/c1-6-3-2-4-7(8)5-6/h3,5H,2,4H2,1,8H3
InChIKeyZPFGPMCOIHQZAL-UHFFFAOYSA-N
MW124.26 g/mol
LogP0.98
Rot. Bonds

About (3-methylcyclohexa-1,3-dien-1-yl)silane

(3-methylcyclohexa-1,3-dien-1-yl)silane (PubChem CID 173485389) has the molecular formula C7H12Si and a molecular weight of 124.26 g/mol. Its IUPAC name is (3-methylcyclohexa-1,3-dien-1-yl)silane.

Molecular Properties

Compound Name(3-methylcyclohexa-1,3-dien-1-yl)silane
PubChem CID173485389
Molecular FormulaC7H12Si
Molecular Weight124.26 g/mol
Exact Mass124.07
IUPAC Name(3-methylcyclohexa-1,3-dien-1-yl)silane
SMILESCC1=CCCC([SiH3])=C1
InChIInChI=1S/C7H12Si/c1-6-3-2-4-7(8)5-6/h3,5H,2,4H2,1,8H3
InChIKeyZPFGPMCOIHQZAL-UHFFFAOYSA-N
XLogP0.98
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds
Heavy Atoms8
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500124.26
LogP ≤ 50.98
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

Computed Properties (RDKit)

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

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Related Compounds

sodium;hydride;(3-methylcyclopenta-1,3-dien-1-yl)silane
CID 173341629
1-ethoxy-3-methylcyclohexa-1,3-diene
CID 21315553
1-ethyl-3-methylcyclohexa-1,3-diene
CID 18512584
(3-methylcyclohexa-1,3-dien-1-yl)methanol
CID 123140542
ethane;1-methylcyclobutene
CID 91484029
1-methylcyclobutene;sulfane
CID 90109296
methyl 3-methylcyclohexa-1,3-diene-1-carboxylate
CID 12533909
(1E,5E)-1,5,9-trimethylcyclododeca-1,5,9-triene
CID 139597866
3-(3-methylcyclohexa-1,3-dien-1-yl)thiophene
CID 145460743
1-(cyclohexa-1,3-dien-1-ylmethyl)-3-methylcyclohexa-1,3-diene
CID 163751542
ethane;3-methylcyclohepta-1,3-diene-1-carbonitrile
CID 143896535
1-bromo-2-methyl-4-(3-methylcyclohexa-1,3-dien-1-yl)benzene
CID 173119276

Frequently Asked Questions

What is the IUPAC name of (3-methylcyclohexa-1,3-dien-1-yl)silane?
The IUPAC name of (3-methylcyclohexa-1,3-dien-1-yl)silane (CID 173485389) is (3-methylcyclohexa-1,3-dien-1-yl)silane.
What is the SMILES notation for (3-methylcyclohexa-1,3-dien-1-yl)silane?
The canonical SMILES for (3-methylcyclohexa-1,3-dien-1-yl)silane is CC1=CCCC([SiH3])=C1.
What is the InChIKey of (3-methylcyclohexa-1,3-dien-1-yl)silane?
The InChIKey is ZPFGPMCOIHQZAL-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H12Si/c1-6-3-2-4-7(8)5-6/h3,5H,2,4H2,1,8H3.
What are the key properties of (3-methylcyclohexa-1,3-dien-1-yl)silane?
(3-methylcyclohexa-1,3-dien-1-yl)silane has a molecular weight of 124.26 g/mol, XLogP of 0.98, 0 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for (3-methylcyclohexa-1,3-dien-1-yl)silane is sourced from PubChem (CID 173485389), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).