2,3,3a,4-tetrahydro-1H-inden-1-yl-(1-propylcyclohexa-2,4-dien-1-yl)silane

C18H26Si — CID 151617768

IUPAC2,3,3a,4-tetrahydro-1H-inden-1-yl-(1-propylcyclohexa-2,4-dien-1-yl)silane
SMILESCCCC1([SiH2]C2CCC3CC=CC=C32)C=CC=CC1
InChIInChI=1S/C18H26Si/c1-2-12-18(13-6-3-7-14-18)19-17-11-10-15-8-4-5-9-16(15)17/h3-7,9,13,15,17H,2,8,10-12,14,19H2,1H3
InChIKeyQNWOSZKGXCIDPN-UHFFFAOYSA-N
MW270.49 g/mol
LogP4.71
Rot. Bonds4

About 2,3,3a,4-tetrahydro-1H-inden-1-yl-(1-propylcyclohexa-2,4-dien-1-yl)silane

2,3,3a,4-tetrahydro-1H-inden-1-yl-(1-propylcyclohexa-2,4-dien-1-yl)silane (PubChem CID 151617768) has the molecular formula C18H26Si and a molecular weight of 270.49 g/mol. Its IUPAC name is 2,3,3a,4-tetrahydro-1H-inden-1-yl-(1-propylcyclohexa-2,4-dien-1-yl)silane.

Molecular Properties

Compound Name2,3,3a,4-tetrahydro-1H-inden-1-yl-(1-propylcyclohexa-2,4-dien-1-yl)silane
PubChem CID151617768
Molecular FormulaC18H26Si
Molecular Weight270.49 g/mol
Exact Mass270.18
IUPAC Name2,3,3a,4-tetrahydro-1H-inden-1-yl-(1-propylcyclohexa-2,4-dien-1-yl)silane
SMILESCCCC1([SiH2]C2CCC3CC=CC=C32)C=CC=CC1
InChIInChI=1S/C18H26Si/c1-2-12-18(13-6-3-7-14-18)19-17-11-10-15-8-4-5-9-16(15)17/h3-7,9,13,15,17H,2,8,10-12,14,19H2,1H3
InChIKeyQNWOSZKGXCIDPN-UHFFFAOYSA-N
XLogP4.71
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500270.49
LogP ≤ 54.71
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

CID 134983248
CID 134983248
1,2,3,4-tetra(cyclohexa-2,4-dien-1-yl)-1H-silole
CID 123399072
bis(2,3,3a,7a-tetrahydro-1H-inden-1-yl)-dimethylsilane
CID 21982021
CID 134899402
CID 134899402
CID 134899904
CID 134899904
[(1E)-1-(2-but-3-enylcyclopentylidene)but-3-enyl]-trimethylsilane
CID 135031511
(S,E)-triethyl(2-(4-(prop-1-en-2-yl)cyclohex-1-en-1-yl)vinyl)silane
CID 154701868
Trimethyl(2,3,3a,4,6,7,8,9-octahydro-1H-cyclopenta[a]naphthalen-5-yl)silane
CID 13273605
tert-butyl-dimethyl-(4,5,6,7-tetrahydro-1H-inden-1-ylmethyl)silane
CID 17783004
tert-butyl-dimethyl-[(2-methyl-4,5,6,7-tetrahydro-1H-inden-1-yl)methyl]silane
CID 17783008
tert-butyl-dimethyl-[(1-methyl-4,5,6,7-tetrahydro-1H-inden-2-yl)methyl]silane
CID 17783024
tert-butyl-dimethyl-[(3-methyl-4,5,6,7-tetrahydro-1H-inden-1-yl)methyl]silane
CID 17783035

Frequently Asked Questions

What is the IUPAC name of 2,3,3a,4-tetrahydro-1H-inden-1-yl-(1-propylcyclohexa-2,4-dien-1-yl)silane?
The IUPAC name of 2,3,3a,4-tetrahydro-1H-inden-1-yl-(1-propylcyclohexa-2,4-dien-1-yl)silane (CID 151617768) is 2,3,3a,4-tetrahydro-1H-inden-1-yl-(1-propylcyclohexa-2,4-dien-1-yl)silane.
What is the SMILES notation for 2,3,3a,4-tetrahydro-1H-inden-1-yl-(1-propylcyclohexa-2,4-dien-1-yl)silane?
The canonical SMILES for 2,3,3a,4-tetrahydro-1H-inden-1-yl-(1-propylcyclohexa-2,4-dien-1-yl)silane is CCCC1([SiH2]C2CCC3CC=CC=C32)C=CC=CC1.
What is the InChIKey of 2,3,3a,4-tetrahydro-1H-inden-1-yl-(1-propylcyclohexa-2,4-dien-1-yl)silane?
The InChIKey is QNWOSZKGXCIDPN-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H26Si/c1-2-12-18(13-6-3-7-14-18)19-17-11-10-15-8-4-5-9-16(15)17/h3-7,9,13,15,17H,2,8,10-12,14,19H2,1H3.
What are the key properties of 2,3,3a,4-tetrahydro-1H-inden-1-yl-(1-propylcyclohexa-2,4-dien-1-yl)silane?
2,3,3a,4-tetrahydro-1H-inden-1-yl-(1-propylcyclohexa-2,4-dien-1-yl)silane has a molecular weight of 270.49 g/mol, XLogP of 4.71, 4 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for 2,3,3a,4-tetrahydro-1H-inden-1-yl-(1-propylcyclohexa-2,4-dien-1-yl)silane is sourced from PubChem (CID 151617768), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).