(3-cyclohexyloxiran-2-yl)-methylsilane;hydrate

C9H20O2Si — CID 175312809

IUPAC(3-cyclohexyloxiran-2-yl)-methylsilane;hydrate
SMILESC[SiH2]C1OC1C1CCCCC1.O
InChIInChI=1S/C9H18OSi.H2O/c1-11-9-8(10-9)7-5-3-2-4-6-7;/h7-9H,2-6,11H2,1H3;1H2
InChIKeyRIPAPMXFFXXKMC-UHFFFAOYSA-N
MW188.34 g/mol
LogP0.68
Rot. Bonds2

About (3-cyclohexyloxiran-2-yl)-methylsilane;hydrate

(3-cyclohexyloxiran-2-yl)-methylsilane;hydrate (PubChem CID 175312809) has the molecular formula C9H20O2Si and a molecular weight of 188.34 g/mol. Its IUPAC name is (3-cyclohexyloxiran-2-yl)-methylsilane;hydrate.

Molecular Properties

Compound Name(3-cyclohexyloxiran-2-yl)-methylsilane;hydrate
PubChem CID175312809
Molecular FormulaC9H20O2Si
Molecular Weight188.34 g/mol
Exact Mass188.12
IUPAC Name(3-cyclohexyloxiran-2-yl)-methylsilane;hydrate
SMILESC[SiH2]C1OC1C1CCCCC1.O
InChIInChI=1S/C9H18OSi.H2O/c1-11-9-8(10-9)7-5-3-2-4-6-7;/h7-9H,2-6,11H2,1H3;1H2
InChIKeyRIPAPMXFFXXKMC-UHFFFAOYSA-N
XLogP0.68
TPSA44.03 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500188.34
LogP ≤ 50.68
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'heavy_metal', 'substructure': 'N/A'}, {'alert_name': 'Three-membered_heterocycle', 'substructure': 'N/A'}

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Related Compounds

(3-cyclohexyloxiran-2-yl)-methylsilane
CID 175312810
(2S,3R)-2,3-dicyclohexyloxirane
CID 169013366
(4S,5S)-4,5-dicyclohexyl-2-methyl-1,3,2-dioxaborolane
CID 10354715
(4aR)-2,3,4,4a,5,6,7,8,9,9a-decahydro-1H-benzo[7]annulene
CID 58427678
cyclohexylcycloheptane
CID 524589
cyclononylcycloicosane
CID 123187062
[(2S,3R)-2-cyclohexyl-4-methylideneoxetan-3-yl]-trimethylsilane
CID 72735701
4,5-dicyclohexyl-2-hydroxy-1,3,2λ5-dioxaphospholane 2-oxide
CID 58900627
2-cyclohexyl-3-ethenyloxirane
CID 12669133
4,5-dicyclohexyl-2-propan-2-ylidene-1,3-dioxolane
CID 174373573
azane;cyclohexylcyclohexane
CID 66583255
1-cyclohexyl-4-[4-[4-[4-[4-(4-cyclohexylcyclohexyl)cyclohexyl]cyclohexyl]cyclohexyl]cyclohexyl]cyclohexane
CID 123286414

Frequently Asked Questions

What is the IUPAC name of (3-cyclohexyloxiran-2-yl)-methylsilane;hydrate?
The IUPAC name of (3-cyclohexyloxiran-2-yl)-methylsilane;hydrate (CID 175312809) is (3-cyclohexyloxiran-2-yl)-methylsilane;hydrate.
What is the SMILES notation for (3-cyclohexyloxiran-2-yl)-methylsilane;hydrate?
The canonical SMILES for (3-cyclohexyloxiran-2-yl)-methylsilane;hydrate is C[SiH2]C1OC1C1CCCCC1.O.
What is the InChIKey of (3-cyclohexyloxiran-2-yl)-methylsilane;hydrate?
The InChIKey is RIPAPMXFFXXKMC-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H18OSi.H2O/c1-11-9-8(10-9)7-5-3-2-4-6-7;/h7-9H,2-6,11H2,1H3;1H2.
What are the key properties of (3-cyclohexyloxiran-2-yl)-methylsilane;hydrate?
(3-cyclohexyloxiran-2-yl)-methylsilane;hydrate has a molecular weight of 188.34 g/mol, XLogP of 0.68, 2 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for (3-cyclohexyloxiran-2-yl)-methylsilane;hydrate is sourced from PubChem (CID 175312809), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).