[(1R)-2,2-dichloro-1-(cyclohexen-1-yl)cyclopropyl]oxy-tri(propan-2-yl)silane

C18H32Cl2OSi — CID 102255201

IUPAC[(1R)-2,2-dichloro-1-(cyclohexen-1-yl)cyclopropyl]oxy-tri(propan-2-yl)silane
SMILESCC(C)[Si](O[C@@]1(C2=CCCCC2)CC1(Cl)Cl)(C(C)C)C(C)C
InChIInChI=1S/C18H32Cl2OSi/c1-13(2)22(14(3)4,15(5)6)21-17(12-18(17,19)20)16-10-8-7-9-11-16/h10,13-15H,7-9,11-12H2,1-6H3/t17-/m1/s1
InChIKeyQXPDDFAZFFTCMV-QGZVFWFLSA-N
MW363.45 g/mol
LogP7.00
Rot. Bonds6

About [(1R)-2,2-dichloro-1-(cyclohexen-1-yl)cyclopropyl]oxy-tri(propan-2-yl)silane

[(1R)-2,2-dichloro-1-(cyclohexen-1-yl)cyclopropyl]oxy-tri(propan-2-yl)silane (PubChem CID 102255201) has the molecular formula C18H32Cl2OSi and a molecular weight of 363.45 g/mol. Its IUPAC name is [(1R)-2,2-dichloro-1-(cyclohexen-1-yl)cyclopropyl]oxy-tri(propan-2-yl)silane.

Molecular Properties

Compound Name[(1R)-2,2-dichloro-1-(cyclohexen-1-yl)cyclopropyl]oxy-tri(propan-2-yl)silane
PubChem CID102255201
Molecular FormulaC18H32Cl2OSi
Molecular Weight363.45 g/mol
Exact Mass362.16
IUPAC Name[(1R)-2,2-dichloro-1-(cyclohexen-1-yl)cyclopropyl]oxy-tri(propan-2-yl)silane
SMILESCC(C)[Si](O[C@@]1(C2=CCCCC2)CC1(Cl)Cl)(C(C)C)C(C)C
InChIInChI=1S/C18H32Cl2OSi/c1-13(2)22(14(3)4,15(5)6)21-17(12-18(17,19)20)16-10-8-7-9-11-16/h10,13-15H,7-9,11-12H2,1-6H3/t17-/m1/s1
InChIKeyQXPDDFAZFFTCMV-QGZVFWFLSA-N
XLogP7.00
TPSA9.23 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds6
Heavy Atoms22
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500363.45
LogP ≤ 57.00
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

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

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Related Compounds

trans-(1S,2S)-1-(cyclopenten-1-yl)-2-[2-tri(propan-2-yl)silyloxyethyl]cyclopropan-1-ol
CID 134931231
1-(cyclohexen-1-yl)cyclohexan-1-amine
CID 56996461
2-(cyclohexen-1-yl)-2-ethylpyrrolidine
CID 106653516
N-[[2-(cyclohexen-1-yl)spiro[3.4]octan-2-yl]methyl]propan-2-amine
CID 116662298
(1R,5S)-6-(cyclohexen-1-yl)-6-methoxybicyclo[3.1.0]hexane
CID 101077777
6-(cyclohexen-1-yl)-1,6-di(cyclopenten-1-yl)cyclohexene
CID 141056447
3-(cyclohepten-1-yl)-5,5-dimethylthian-3-ol
CID 106651318
chloro-ethyl-dimethylsilane;1-(cyclohepten-1-yl)cycloheptene
CID 66646162
cycloocten-1-yl-di(propan-2-yloxy)borane
CID 159470361
1-(cyclohexen-1-yl)-4,4-dimethylcyclohexan-1-ol
CID 106651138
N-[[2-(cyclohexen-1-yl)-7-oxaspiro[3.5]nonan-2-yl]methyl]propan-2-amine
CID 116662294
methyl (5S,7R)-3-(cyclohexen-1-yl)adamantane-1-carboxylate
CID 101117887

Frequently Asked Questions

What is the IUPAC name of [(1R)-2,2-dichloro-1-(cyclohexen-1-yl)cyclopropyl]oxy-tri(propan-2-yl)silane?
The IUPAC name of [(1R)-2,2-dichloro-1-(cyclohexen-1-yl)cyclopropyl]oxy-tri(propan-2-yl)silane (CID 102255201) is [(1R)-2,2-dichloro-1-(cyclohexen-1-yl)cyclopropyl]oxy-tri(propan-2-yl)silane.
What is the SMILES notation for [(1R)-2,2-dichloro-1-(cyclohexen-1-yl)cyclopropyl]oxy-tri(propan-2-yl)silane?
The canonical SMILES for [(1R)-2,2-dichloro-1-(cyclohexen-1-yl)cyclopropyl]oxy-tri(propan-2-yl)silane is CC(C)[Si](O[C@@]1(C2=CCCCC2)CC1(Cl)Cl)(C(C)C)C(C)C.
What is the InChIKey of [(1R)-2,2-dichloro-1-(cyclohexen-1-yl)cyclopropyl]oxy-tri(propan-2-yl)silane?
The InChIKey is QXPDDFAZFFTCMV-QGZVFWFLSA-N. The full InChI is InChI=1S/C18H32Cl2OSi/c1-13(2)22(14(3)4,15(5)6)21-17(12-18(17,19)20)16-10-8-7-9-11-16/h10,13-15H,7-9,11-12H2,1-6H3/t17-/m1/s1.
What are the key properties of [(1R)-2,2-dichloro-1-(cyclohexen-1-yl)cyclopropyl]oxy-tri(propan-2-yl)silane?
[(1R)-2,2-dichloro-1-(cyclohexen-1-yl)cyclopropyl]oxy-tri(propan-2-yl)silane has a molecular weight of 363.45 g/mol, XLogP of 7.00, 6 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for [(1R)-2,2-dichloro-1-(cyclohexen-1-yl)cyclopropyl]oxy-tri(propan-2-yl)silane is sourced from PubChem (CID 102255201), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).