methyl-[[methyl(propyl)phosphanyl]methyl]-propylphosphane;dihydrobromide

C9H24Br2P2 — CID 173222667

IUPACmethyl-[[methyl(propyl)phosphanyl]methyl]-propylphosphane;dihydrobromide
SMILESBr.Br.CCCP(C)CP(C)CCC
InChIInChI=1S/C9H22P2.2BrH/c1-5-7-10(3)9-11(4)8-6-2;;/h5-9H2,1-4H3;2*1H
InChIKeyCXNXOECNVKNPDE-UHFFFAOYSA-N
MW354.05 g/mol
LogP5.14
Rot. Bonds6

About methyl-[[methyl(propyl)phosphanyl]methyl]-propylphosphane;dihydrobromide

methyl-[[methyl(propyl)phosphanyl]methyl]-propylphosphane;dihydrobromide (PubChem CID 173222667) has the molecular formula C9H24Br2P2 and a molecular weight of 354.05 g/mol. Its IUPAC name is methyl-[[methyl(propyl)phosphanyl]methyl]-propylphosphane;dihydrobromide.

Molecular Properties

Compound Namemethyl-[[methyl(propyl)phosphanyl]methyl]-propylphosphane;dihydrobromide
PubChem CID173222667
Molecular FormulaC9H24Br2P2
Molecular Weight354.05 g/mol
Exact Mass351.97
IUPAC Namemethyl-[[methyl(propyl)phosphanyl]methyl]-propylphosphane;dihydrobromide
SMILESBr.Br.CCCP(C)CP(C)CCC
InChIInChI=1S/C9H22P2.2BrH/c1-5-7-10(3)9-11(4)8-6-2;;/h5-9H2,1-4H3;2*1H
InChIKeyCXNXOECNVKNPDE-UHFFFAOYSA-N
XLogP5.14
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds6
Heavy Atoms13
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500354.05
LogP ≤ 55.14
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'phosphor', 'substructure': 'N/A'}

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Related Compounds

hexyl-[[hexyl(methyl)phosphanyl]methyl]-methylphosphane
CID 23501422
dimethyl(propyl)phosphane
CID 6396515
dipropylphosphanylmethyl(dipropyl)phosphane
CID 23420802
bis(dipropylphosphanylmethyl)-propylphosphane
CID 90108220
2-[methyl(propyl)phosphanyl]ethanimine
CID 155171186
benzyl-methyl-propylphosphane
CID 13024967
ethanol;gold;hydrobromide
CID 175287500
methyl-di(tetradecyl)phosphane
CID 89485367
hexyl-methyl-octylphosphane
CID 22497581
diheptyl(methyl)phosphane
CID 22497718
butane;sulfane
CID 162203569
nickel(2+);bis(tripropylphosphane);dichloride
CID 173106713

Frequently Asked Questions

What is the IUPAC name of methyl-[[methyl(propyl)phosphanyl]methyl]-propylphosphane;dihydrobromide?
The IUPAC name of methyl-[[methyl(propyl)phosphanyl]methyl]-propylphosphane;dihydrobromide (CID 173222667) is methyl-[[methyl(propyl)phosphanyl]methyl]-propylphosphane;dihydrobromide.
What is the SMILES notation for methyl-[[methyl(propyl)phosphanyl]methyl]-propylphosphane;dihydrobromide?
The canonical SMILES for methyl-[[methyl(propyl)phosphanyl]methyl]-propylphosphane;dihydrobromide is Br.Br.CCCP(C)CP(C)CCC.
What is the InChIKey of methyl-[[methyl(propyl)phosphanyl]methyl]-propylphosphane;dihydrobromide?
The InChIKey is CXNXOECNVKNPDE-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H22P2.2BrH/c1-5-7-10(3)9-11(4)8-6-2;;/h5-9H2,1-4H3;2*1H.
What are the key properties of methyl-[[methyl(propyl)phosphanyl]methyl]-propylphosphane;dihydrobromide?
methyl-[[methyl(propyl)phosphanyl]methyl]-propylphosphane;dihydrobromide has a molecular weight of 354.05 g/mol, XLogP of 5.14, 6 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for methyl-[[methyl(propyl)phosphanyl]methyl]-propylphosphane;dihydrobromide is sourced from PubChem (CID 173222667), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).