but-1-ene;2-diphenylphosphanylethyl(diphenyl)phosphane;pent-1-ene;platinum(2+)

C35H40P2Pt — CID 139239631

IUPACbut-1-ene;2-diphenylphosphanylethyl(diphenyl)phosphane;pent-1-ene;platinum(2+)
SMILESC=CCC[CH2-].C=CC[CH2-].[Pt+2].c1ccc(P(CCP(c2ccccc2)c2ccccc2)c2ccccc2)cc1
InChIInChI=1S/C26H24P2.C5H9.C4H7.Pt/c1-5-13-23(14-6-1)27(24-15-7-2-8-16-24)21-22-28(25-17-9-3-10-18-25)26-19-11-4-12-20-26;1-3-5-4-2;1-3-4-2;/h1-20H,21-22H2;3H,1-2,4-5H2;3H,1-2,4H2;/q;2*-1;+2
InChIKeyHDCZJDPNZQXYMP-UHFFFAOYSA-N
MW717.73 g/mol
LogP8.43
Rot. Bonds10

About but-1-ene;2-diphenylphosphanylethyl(diphenyl)phosphane;pent-1-ene;platinum(2+)

but-1-ene;2-diphenylphosphanylethyl(diphenyl)phosphane;pent-1-ene;platinum(2+) (PubChem CID 139239631) has the molecular formula C35H40P2Pt and a molecular weight of 717.73 g/mol. Its IUPAC name is but-1-ene;2-diphenylphosphanylethyl(diphenyl)phosphane;pent-1-ene;platinum(2+).

Molecular Properties

Compound Namebut-1-ene;2-diphenylphosphanylethyl(diphenyl)phosphane;pent-1-ene;platinum(2+)
PubChem CID139239631
Molecular FormulaC35H40P2Pt
Molecular Weight717.73 g/mol
Exact Mass717.23
IUPAC Namebut-1-ene;2-diphenylphosphanylethyl(diphenyl)phosphane;pent-1-ene;platinum(2+)
SMILESC=CCC[CH2-].C=CC[CH2-].[Pt+2].c1ccc(P(CCP(c2ccccc2)c2ccccc2)c2ccccc2)cc1
InChIInChI=1S/C26H24P2.C5H9.C4H7.Pt/c1-5-13-23(14-6-1)27(24-15-7-2-8-16-24)21-22-28(25-17-9-3-10-18-25)26-19-11-4-12-20-26;1-3-5-4-2;1-3-4-2;/h1-20H,21-22H2;3H,1-2,4-5H2;3H,1-2,4H2;/q;2*-1;+2
InChIKeyHDCZJDPNZQXYMP-UHFFFAOYSA-N
XLogP8.43
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds10
Heavy Atoms38
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 500717.73
LogP ≤ 58.43
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

Computed Properties (RDKit)

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

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Related Compounds

2-diphenylphosphanylethyl(diphenyl)phosphane;bis(hept-1-ene);platinum(2+)
CID 139239614
bis(but-1-ene);3-diphenylphosphanylpropyl(diphenyl)phosphane;platinum(2+)
CID 139239630
bis(hept-1-ene);platinum(2+);bis(triphenylphosphane)
CID 139239662
3-diphenylphosphanylpropyl(diphenyl)phosphane;heptane;platinum(2+)
CID 134888828
copper;2-diphenylphosphanylethyl(diphenyl)phosphane
CID 172691884
bis(2-diphenylphosphanylethyl(diphenyl)phosphane);gold(1+);bromide
CID 173374421
2-diphenylphosphanylethyl(diphenyl)phosphane;platinum;prop-2-enenitrile
CID 11828411
chloronickel;2-diphenylphosphanylethyl(diphenyl)phosphane
CID 12000429
bromogold;bis(2-diphenylphosphanylethyl(diphenyl)phosphane)
CID 15017629
2-diphenylphosphanylethyl(diphenyl)phosphane;bis(gold(1+));bis(triphenylphosphane);dichloride
CID 11981349
copper(1+);pent-1-ene
CID 11029887
chromium;ethyl(diphenyl)phosphane
CID 152678584

Frequently Asked Questions

What is the IUPAC name of but-1-ene;2-diphenylphosphanylethyl(diphenyl)phosphane;pent-1-ene;platinum(2+)?
The IUPAC name of but-1-ene;2-diphenylphosphanylethyl(diphenyl)phosphane;pent-1-ene;platinum(2+) (CID 139239631) is but-1-ene;2-diphenylphosphanylethyl(diphenyl)phosphane;pent-1-ene;platinum(2+).
What is the SMILES notation for but-1-ene;2-diphenylphosphanylethyl(diphenyl)phosphane;pent-1-ene;platinum(2+)?
The canonical SMILES for but-1-ene;2-diphenylphosphanylethyl(diphenyl)phosphane;pent-1-ene;platinum(2+) is C=CCC[CH2-].C=CC[CH2-].[Pt+2].c1ccc(P(CCP(c2ccccc2)c2ccccc2)c2ccccc2)cc1.
What is the InChIKey of but-1-ene;2-diphenylphosphanylethyl(diphenyl)phosphane;pent-1-ene;platinum(2+)?
The InChIKey is HDCZJDPNZQXYMP-UHFFFAOYSA-N. The full InChI is InChI=1S/C26H24P2.C5H9.C4H7.Pt/c1-5-13-23(14-6-1)27(24-15-7-2-8-16-24)21-22-28(25-17-9-3-10-18-25)26-19-11-4-12-20-26;1-3-5-4-2;1-3-4-2;/h1-20H,21-22H2;3H,1-2,4-5H2;3H,1-2,4H2;/q;2*-1;+2.
What are the key properties of but-1-ene;2-diphenylphosphanylethyl(diphenyl)phosphane;pent-1-ene;platinum(2+)?
but-1-ene;2-diphenylphosphanylethyl(diphenyl)phosphane;pent-1-ene;platinum(2+) has a molecular weight of 717.73 g/mol, XLogP of 8.43, 10 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for but-1-ene;2-diphenylphosphanylethyl(diphenyl)phosphane;pent-1-ene;platinum(2+) is sourced from PubChem (CID 139239631), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).