dimethyl-bis[(1R,2S,5R)-5-methyl-2-propan-2-ylcyclohexyl]stannane

C22H44Sn — CID 177420575

IUPACdimethyl-bis[(1R,2S,5R)-5-methyl-2-propan-2-ylcyclohexyl]stannane
SMILESCC(C)[C@@H]1CC[C@@H](C)C[C@H]1[Sn](C)(C)[C@@H]1C[C@H](C)CC[C@H]1C(C)C
InChIInChI=1S/2C10H19.2CH3.Sn/c2*1-8(2)10-6-4-9(3)5-7-10;;;/h2*6,8-10H,4-5,7H2,1-3H3;2*1H3;/t2*9-,10-;;;/m00.../s1
InChIKeyMEEHCJPHWAUBDP-LBKHRAORSA-N
MW427.31 g/mol
LogP7.62
Rot. Bonds4

About dimethyl-bis[(1R,2S,5R)-5-methyl-2-propan-2-ylcyclohexyl]stannane

dimethyl-bis[(1R,2S,5R)-5-methyl-2-propan-2-ylcyclohexyl]stannane (PubChem CID 177420575) has the molecular formula C22H44Sn and a molecular weight of 427.31 g/mol. Its IUPAC name is dimethyl-bis[(1R,2S,5R)-5-methyl-2-propan-2-ylcyclohexyl]stannane.

Molecular Properties

Compound Namedimethyl-bis[(1R,2S,5R)-5-methyl-2-propan-2-ylcyclohexyl]stannane
PubChem CID177420575
Molecular FormulaC22H44Sn
Molecular Weight427.31 g/mol
Exact Mass428.25
IUPAC Namedimethyl-bis[(1R,2S,5R)-5-methyl-2-propan-2-ylcyclohexyl]stannane
SMILESCC(C)[C@@H]1CC[C@@H](C)C[C@H]1[Sn](C)(C)[C@@H]1C[C@H](C)CC[C@H]1C(C)C
InChIInChI=1S/2C10H19.2CH3.Sn/c2*1-8(2)10-6-4-9(3)5-7-10;;;/h2*6,8-10H,4-5,7H2,1-3H3;2*1H3;/t2*9-,10-;;;/m00.../s1
InChIKeyMEEHCJPHWAUBDP-LBKHRAORSA-N
XLogP7.62
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds4
Heavy Atoms23
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500427.31
LogP ≤ 57.62
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

Analyze dimethyl-bis[(1R,2S,5R)-5-methyl-2-propan-2-ylcyclohexyl]stannane with MolForge

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Related Compounds

(2S)-4-methyl-1,2-di(propan-2-yl)cyclohexane
CID 169042978
tributyl-[(1R,2S,5R)-5-methyl-2-propan-2-ylcyclohexyl]stannane
CID 71403532
(1R,2R,4S)-2-fluoro-4-methyl-1-propan-2-ylcyclohexane
CID 135011931
(2R)-1,4-dimethyl-2-propan-2-ylcyclohexane
CID 149206895
hexakis[(-)-menthyl]distannane
CID 86177037
(1S,2S,4R)-4-methyl-2-[[(1S,2S,5R)-5-methyl-2-propan-2-ylcyclohexyl]diselanyl]-1-propan-2-ylcyclohexane
CID 11843401
hypochlorous acid;5-methyl-2-propan-2-ylcyclohexan-1-ol
CID 174568794
CID 66630118
CID 66630118
(1S,2R,4R)-4-methyl-2-[(1R,2S,5R)-5-methyl-2-propan-2-ylcyclohexyl]oxy-1-propan-2-ylcyclohexane
CID 142760387
2,4-dimethyl-1-propan-2-ylcyclohexane;propane
CID 143365202
(1S,2R,4R)-4-methyl-2-[[(1R,2S,5R)-5-methyl-2-propan-2-ylcyclohexyl]diselanyl]-1-propan-2-ylcyclohexane
CID 11843260
methyl-tris[[(1R,2S,5R)-5-methyl-2-propan-2-ylcyclohexyl]oxy]silane
CID 101270451

Frequently Asked Questions

What is the IUPAC name of dimethyl-bis[(1R,2S,5R)-5-methyl-2-propan-2-ylcyclohexyl]stannane?
The IUPAC name of dimethyl-bis[(1R,2S,5R)-5-methyl-2-propan-2-ylcyclohexyl]stannane (CID 177420575) is dimethyl-bis[(1R,2S,5R)-5-methyl-2-propan-2-ylcyclohexyl]stannane.
What is the SMILES notation for dimethyl-bis[(1R,2S,5R)-5-methyl-2-propan-2-ylcyclohexyl]stannane?
The canonical SMILES for dimethyl-bis[(1R,2S,5R)-5-methyl-2-propan-2-ylcyclohexyl]stannane is CC(C)[C@@H]1CC[C@@H](C)C[C@H]1[Sn](C)(C)[C@@H]1C[C@H](C)CC[C@H]1C(C)C.
What is the InChIKey of dimethyl-bis[(1R,2S,5R)-5-methyl-2-propan-2-ylcyclohexyl]stannane?
The InChIKey is MEEHCJPHWAUBDP-LBKHRAORSA-N. The full InChI is InChI=1S/2C10H19.2CH3.Sn/c2*1-8(2)10-6-4-9(3)5-7-10;;;/h2*6,8-10H,4-5,7H2,1-3H3;2*1H3;/t2*9-,10-;;;/m00.../s1.
What are the key properties of dimethyl-bis[(1R,2S,5R)-5-methyl-2-propan-2-ylcyclohexyl]stannane?
dimethyl-bis[(1R,2S,5R)-5-methyl-2-propan-2-ylcyclohexyl]stannane has a molecular weight of 427.31 g/mol, XLogP of 7.62, 4 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for dimethyl-bis[(1R,2S,5R)-5-methyl-2-propan-2-ylcyclohexyl]stannane is sourced from PubChem (CID 177420575), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).