hexylsilane;sulfuryl diazide

C6H16N6O2SSi — CID 173397823

IUPAChexylsilane;sulfuryl diazide
SMILESCCCCCC[SiH3].[N-]=[N+]=NS(=O)(=O)N=[N+]=[N-]
InChIInChI=1S/C6H16Si.N6O2S/c1-2-3-4-5-6-7;1-3-5-9(7,8)6-4-2/h2-6H2,1,7H3;
InChIKeyMMEOCZFJXBSQAA-UHFFFAOYSA-N
MW264.39 g/mol
LogP2.20
Rot. Bonds6

About hexylsilane;sulfuryl diazide

hexylsilane;sulfuryl diazide (PubChem CID 173397823) has the molecular formula C6H16N6O2SSi and a molecular weight of 264.39 g/mol. Its IUPAC name is hexylsilane;sulfuryl diazide.

Molecular Properties

Compound Namehexylsilane;sulfuryl diazide
PubChem CID173397823
Molecular FormulaC6H16N6O2SSi
Molecular Weight264.39 g/mol
Exact Mass264.08
IUPAC Namehexylsilane;sulfuryl diazide
SMILESCCCCCC[SiH3].[N-]=[N+]=NS(=O)(=O)N=[N+]=[N-]
InChIInChI=1S/C6H16Si.N6O2S/c1-2-3-4-5-6-7;1-3-5-9(7,8)6-4-2/h2-6H2,1,7H3;
InChIKeyMMEOCZFJXBSQAA-UHFFFAOYSA-N
XLogP2.20
TPSA131.66 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds6
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500264.39
LogP ≤ 52.20
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'azo_A(324)', 'substructure': 'N/A'}, {'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}, {'alert_name': 'Azido_group', 'substructure': 'N/A'}, {'alert_name': 'diazo_group', 'substructure': 'N/A'}, {'alert_name': 'heavy_metal', 'substructure': 'N/A'}

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Related Compounds

N-diazononane-1-sulfonamide
CID 21453350
dodecylsilane
CID 57354986
tricosylsilane;dihydrochloride
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CID 175150014
1-azidotriacontane
CID 71752669
1-azidohexadecane
CID 11230945
heptane;methylsulfonylmethane
CID 176706405
1-azidooctane;hydrochloride
CID 175871639
sulfuric acid;tridecane
CID 91872702
2-azidoethyl decane-1-sulfonate
CID 44625994
CID 174882897
CID 174882897
decan-1-one;rhenium
CID 88777859

Frequently Asked Questions

What is the IUPAC name of hexylsilane;sulfuryl diazide?
The IUPAC name of hexylsilane;sulfuryl diazide (CID 173397823) is hexylsilane;sulfuryl diazide.
What is the SMILES notation for hexylsilane;sulfuryl diazide?
The canonical SMILES for hexylsilane;sulfuryl diazide is CCCCCC[SiH3].[N-]=[N+]=NS(=O)(=O)N=[N+]=[N-].
What is the InChIKey of hexylsilane;sulfuryl diazide?
The InChIKey is MMEOCZFJXBSQAA-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H16Si.N6O2S/c1-2-3-4-5-6-7;1-3-5-9(7,8)6-4-2/h2-6H2,1,7H3;.
What are the key properties of hexylsilane;sulfuryl diazide?
hexylsilane;sulfuryl diazide has a molecular weight of 264.39 g/mol, XLogP of 2.20, 6 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for hexylsilane;sulfuryl diazide is sourced from PubChem (CID 173397823), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).