[1-(benzenesulfonyl)-3,3-dimethylbutyl]-trimethylgermane

C15H26GeO2S — CID 175532591

IUPAC[1-(benzenesulfonyl)-3,3-dimethylbutyl]-trimethylgermane
SMILESCC(C)(C)CC(S(=O)(=O)c1ccccc1)[Ge](C)(C)C
InChIInChI=1S/C15H26GeO2S/c1-15(2,3)12-14(16(4,5)6)19(17,18)13-10-8-7-9-11-13/h7-11,14H,12H2,1-6H3
InChIKeyDYAGDZHDKNMINV-UHFFFAOYSA-N
MW343.05 g/mol
LogP4.14
Rot. Bonds4

About [1-(benzenesulfonyl)-3,3-dimethylbutyl]-trimethylgermane

[1-(benzenesulfonyl)-3,3-dimethylbutyl]-trimethylgermane (PubChem CID 175532591) has the molecular formula C15H26GeO2S and a molecular weight of 343.05 g/mol. Its IUPAC name is [1-(benzenesulfonyl)-3,3-dimethylbutyl]-trimethylgermane.

Molecular Properties

Compound Name[1-(benzenesulfonyl)-3,3-dimethylbutyl]-trimethylgermane
PubChem CID175532591
Molecular FormulaC15H26GeO2S
Molecular Weight343.05 g/mol
Exact Mass344.09
IUPAC Name[1-(benzenesulfonyl)-3,3-dimethylbutyl]-trimethylgermane
SMILESCC(C)(C)CC(S(=O)(=O)c1ccccc1)[Ge](C)(C)C
InChIInChI=1S/C15H26GeO2S/c1-15(2,3)12-14(16(4,5)6)19(17,18)13-10-8-7-9-11-13/h7-11,14H,12H2,1-6H3
InChIKeyDYAGDZHDKNMINV-UHFFFAOYSA-N
XLogP4.14
TPSA34.14 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500343.05
LogP ≤ 54.14
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

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Sulfone, allyl p-tolyl
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Butyl phenyl sulfone
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Methoxymethyl Phenyl Sulfone
CID 366072

Frequently Asked Questions

What is the IUPAC name of [1-(benzenesulfonyl)-3,3-dimethylbutyl]-trimethylgermane?
The IUPAC name of [1-(benzenesulfonyl)-3,3-dimethylbutyl]-trimethylgermane (CID 175532591) is [1-(benzenesulfonyl)-3,3-dimethylbutyl]-trimethylgermane.
What is the SMILES notation for [1-(benzenesulfonyl)-3,3-dimethylbutyl]-trimethylgermane?
The canonical SMILES for [1-(benzenesulfonyl)-3,3-dimethylbutyl]-trimethylgermane is CC(C)(C)CC(S(=O)(=O)c1ccccc1)[Ge](C)(C)C.
What is the InChIKey of [1-(benzenesulfonyl)-3,3-dimethylbutyl]-trimethylgermane?
The InChIKey is DYAGDZHDKNMINV-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H26GeO2S/c1-15(2,3)12-14(16(4,5)6)19(17,18)13-10-8-7-9-11-13/h7-11,14H,12H2,1-6H3.
What are the key properties of [1-(benzenesulfonyl)-3,3-dimethylbutyl]-trimethylgermane?
[1-(benzenesulfonyl)-3,3-dimethylbutyl]-trimethylgermane has a molecular weight of 343.05 g/mol, XLogP of 4.14, 4 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for [1-(benzenesulfonyl)-3,3-dimethylbutyl]-trimethylgermane is sourced from PubChem (CID 175532591), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).