(2-methylphenyl)-[2,3,4,5-tetramethyl-5-(1-methylcyclohexa-2,4-dien-1-yl)cyclopenta-1,3-dien-1-yl]silane

C23H30Si — CID 152749656

IUPAC(2-methylphenyl)-[2,3,4,5-tetramethyl-5-(1-methylcyclohexa-2,4-dien-1-yl)cyclopenta-1,3-dien-1-yl]silane
SMILESCC1=C(C)C(C)(C2(C)C=CC=CC2)C([SiH2]c2ccccc2C)=C1C
InChIInChI=1S/C23H30Si/c1-16-12-8-9-13-20(16)24-21-18(3)17(2)19(4)23(21,6)22(5)14-10-7-11-15-22/h7-14H,15,24H2,1-6H3
InChIKeyIWQAGDKLCCCVSK-UHFFFAOYSA-N
MW334.58 g/mol
LogP4.94
Rot. Bonds3

About (2-methylphenyl)-[2,3,4,5-tetramethyl-5-(1-methylcyclohexa-2,4-dien-1-yl)cyclopenta-1,3-dien-1-yl]silane

(2-methylphenyl)-[2,3,4,5-tetramethyl-5-(1-methylcyclohexa-2,4-dien-1-yl)cyclopenta-1,3-dien-1-yl]silane (PubChem CID 152749656) has the molecular formula C23H30Si and a molecular weight of 334.58 g/mol. Its IUPAC name is (2-methylphenyl)-[2,3,4,5-tetramethyl-5-(1-methylcyclohexa-2,4-dien-1-yl)cyclopenta-1,3-dien-1-yl]silane.

Molecular Properties

Compound Name(2-methylphenyl)-[2,3,4,5-tetramethyl-5-(1-methylcyclohexa-2,4-dien-1-yl)cyclopenta-1,3-dien-1-yl]silane
PubChem CID152749656
Molecular FormulaC23H30Si
Molecular Weight334.58 g/mol
Exact Mass334.21
IUPAC Name(2-methylphenyl)-[2,3,4,5-tetramethyl-5-(1-methylcyclohexa-2,4-dien-1-yl)cyclopenta-1,3-dien-1-yl]silane
SMILESCC1=C(C)C(C)(C2(C)C=CC=CC2)C([SiH2]c2ccccc2C)=C1C
InChIInChI=1S/C23H30Si/c1-16-12-8-9-13-20(16)24-21-18(3)17(2)19(4)23(21,6)22(5)14-10-7-11-15-22/h7-14H,15,24H2,1-6H3
InChIKeyIWQAGDKLCCCVSK-UHFFFAOYSA-N
XLogP4.94
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds3
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500334.58
LogP ≤ 54.94
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

tert-Amylbenzene
CID 16295
1,1'-(1,1-Dimethyl-3-methylene-1,3-propanediyl)bisbenzene
CID 80715
Benzene, 1,1'-(1,1,2,2-tetramethyl-1,2-ethanediyl)bis-
CID 74681
Trimethylbenzylsilane
CID 69862
p-Tolyltrimethylsilane
CID 298149
4-(Trimethylsilyl)biphenyl
CID 298146
Benzene, [(dimethylsilyl)methyl]-
CID 6328719
Benzene, 1,1'-(1,3,3-trimethyl-1-propene-1,3-diyl)bis-
CID 5376315
2-Methyl-2-phenyl-undecane
CID 9794112
(1,1-Dimethylbutyl)benzene
CID 16136
2,5-Dimethyl-2,5-diphenylhexane
CID 316705
2,4-Diphenyl-4-methyl-2(e)-pentene
CID 5356300

Frequently Asked Questions

What is the IUPAC name of (2-methylphenyl)-[2,3,4,5-tetramethyl-5-(1-methylcyclohexa-2,4-dien-1-yl)cyclopenta-1,3-dien-1-yl]silane?
The IUPAC name of (2-methylphenyl)-[2,3,4,5-tetramethyl-5-(1-methylcyclohexa-2,4-dien-1-yl)cyclopenta-1,3-dien-1-yl]silane (CID 152749656) is (2-methylphenyl)-[2,3,4,5-tetramethyl-5-(1-methylcyclohexa-2,4-dien-1-yl)cyclopenta-1,3-dien-1-yl]silane.
What is the SMILES notation for (2-methylphenyl)-[2,3,4,5-tetramethyl-5-(1-methylcyclohexa-2,4-dien-1-yl)cyclopenta-1,3-dien-1-yl]silane?
The canonical SMILES for (2-methylphenyl)-[2,3,4,5-tetramethyl-5-(1-methylcyclohexa-2,4-dien-1-yl)cyclopenta-1,3-dien-1-yl]silane is CC1=C(C)C(C)(C2(C)C=CC=CC2)C([SiH2]c2ccccc2C)=C1C.
What is the InChIKey of (2-methylphenyl)-[2,3,4,5-tetramethyl-5-(1-methylcyclohexa-2,4-dien-1-yl)cyclopenta-1,3-dien-1-yl]silane?
The InChIKey is IWQAGDKLCCCVSK-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H30Si/c1-16-12-8-9-13-20(16)24-21-18(3)17(2)19(4)23(21,6)22(5)14-10-7-11-15-22/h7-14H,15,24H2,1-6H3.
What are the key properties of (2-methylphenyl)-[2,3,4,5-tetramethyl-5-(1-methylcyclohexa-2,4-dien-1-yl)cyclopenta-1,3-dien-1-yl]silane?
(2-methylphenyl)-[2,3,4,5-tetramethyl-5-(1-methylcyclohexa-2,4-dien-1-yl)cyclopenta-1,3-dien-1-yl]silane has a molecular weight of 334.58 g/mol, XLogP of 4.94, 3 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for (2-methylphenyl)-[2,3,4,5-tetramethyl-5-(1-methylcyclohexa-2,4-dien-1-yl)cyclopenta-1,3-dien-1-yl]silane is sourced from PubChem (CID 152749656), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).