hydroxy-[[hydroxy(oxido)phosphoryl]methyl]phosphinate;platinum(2+);trans-(1R,2R)-cyclohexane-1,2-diamine

C7H18N2O6P2Pt — CID 11225437

IUPAChydroxy-[[hydroxy(oxido)phosphoryl]methyl]phosphinate;platinum(2+);trans-(1R,2R)-cyclohexane-1,2-diamine
SMILESN[C@@H]1CCCC[C@H]1N.O=P([O-])(O)CP(=O)([O-])O.[Pt+2]
InChIInChI=1S/C6H14N2.CH6O6P2.Pt/c7-5-3-1-2-4-6(5)8;2-8(3,4)1-9(5,6)7;/h5-6H,1-4,7-8H2;1H2,(H2,2,3,4)(H2,5,6,7);/q;;+2/p-2/t5-,6-;;/m1../s1
InChIKeySFLKKSMPAHFWQJ-BNTLRKBRSA-L
MW483.26 g/mol
LogP-1.75
Rot. Bonds2

About hydroxy-[[hydroxy(oxido)phosphoryl]methyl]phosphinate;platinum(2+);trans-(1R,2R)-cyclohexane-1,2-diamine

hydroxy-[[hydroxy(oxido)phosphoryl]methyl]phosphinate;platinum(2+);trans-(1R,2R)-cyclohexane-1,2-diamine (PubChem CID 11225437) has the molecular formula C7H18N2O6P2Pt and a molecular weight of 483.26 g/mol. Its IUPAC name is hydroxy-[[hydroxy(oxido)phosphoryl]methyl]phosphinate;platinum(2+);trans-(1R,2R)-cyclohexane-1,2-diamine.

Molecular Properties

Compound Namehydroxy-[[hydroxy(oxido)phosphoryl]methyl]phosphinate;platinum(2+);trans-(1R,2R)-cyclohexane-1,2-diamine
PubChem CID11225437
Molecular FormulaC7H18N2O6P2Pt
Molecular Weight483.26 g/mol
Exact Mass483.03
IUPAC Namehydroxy-[[hydroxy(oxido)phosphoryl]methyl]phosphinate;platinum(2+);trans-(1R,2R)-cyclohexane-1,2-diamine
SMILESN[C@@H]1CCCC[C@H]1N.O=P([O-])(O)CP(=O)([O-])O.[Pt+2]
InChIInChI=1S/C6H14N2.CH6O6P2.Pt/c7-5-3-1-2-4-6(5)8;2-8(3,4)1-9(5,6)7;/h5-6H,1-4,7-8H2;1H2,(H2,2,3,4)(H2,5,6,7);/q;;+2/p-2/t5-,6-;;/m1../s1
InChIKeySFLKKSMPAHFWQJ-BNTLRKBRSA-L
XLogP-1.75
TPSA172.76 Ų
H-Bond Donors4
H-Bond Acceptors6
Rotatable Bonds2
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500483.26
LogP ≤ 5-1.75
H-Bond Donors ≤ 54
H-Bond Acceptors ≤ 106

Computed Properties (RDKit)

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

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Related Compounds

cyclohexane-1,2-diamine;hydron;platinum(2+);phosphate
CID 3049901
cyclohexane-1,2-diamine;phosphoric acid
CID 70269724
dioxidanium;platinum(2+);trans-(1R,2R)-cyclohexane-1,2-diamine
CID 59971329
oxalic acid;platinum(2+);trans-(1S,2S)-cyclohexane-1,2-diamine
CID 163285607
cyclohexane-1,2-diamine;oxalic acid;platinum(2+)
CID 6394767
bis(cyclohexane-1,2-diamine);oxalate;platinum(4+)
CID 173119560
trans-(1S,2S)-cycloundecane-1,2-diamine
CID 139815756
(2R,3R)-2,3-dihydroxybutanedioate;platinum(2+);trans-(1R,2R)-cyclohexane-1,2-diamine
CID 175900001
ethene;platinum(2+);trans-(1S,2S)-cyclohexane-1,2-diamine;chloride
CID 46224444
bis[[hydroxy(oxido)phosphoryl]methyl]phosphinate
CID 3758106
acetic acid;cyclohexane-1,2-diamine
CID 67321744
acetic acid;trans-(1R,2R)-cyclohexane-1,2-diamine
CID 159991522

Frequently Asked Questions

What is the IUPAC name of hydroxy-[[hydroxy(oxido)phosphoryl]methyl]phosphinate;platinum(2+);trans-(1R,2R)-cyclohexane-1,2-diamine?
The IUPAC name of hydroxy-[[hydroxy(oxido)phosphoryl]methyl]phosphinate;platinum(2+);trans-(1R,2R)-cyclohexane-1,2-diamine (CID 11225437) is hydroxy-[[hydroxy(oxido)phosphoryl]methyl]phosphinate;platinum(2+);trans-(1R,2R)-cyclohexane-1,2-diamine.
What is the SMILES notation for hydroxy-[[hydroxy(oxido)phosphoryl]methyl]phosphinate;platinum(2+);trans-(1R,2R)-cyclohexane-1,2-diamine?
The canonical SMILES for hydroxy-[[hydroxy(oxido)phosphoryl]methyl]phosphinate;platinum(2+);trans-(1R,2R)-cyclohexane-1,2-diamine is N[C@@H]1CCCC[C@H]1N.O=P([O-])(O)CP(=O)([O-])O.[Pt+2].
What is the InChIKey of hydroxy-[[hydroxy(oxido)phosphoryl]methyl]phosphinate;platinum(2+);trans-(1R,2R)-cyclohexane-1,2-diamine?
The InChIKey is SFLKKSMPAHFWQJ-BNTLRKBRSA-L. The full InChI is InChI=1S/C6H14N2.CH6O6P2.Pt/c7-5-3-1-2-4-6(5)8;2-8(3,4)1-9(5,6)7;/h5-6H,1-4,7-8H2;1H2,(H2,2,3,4)(H2,5,6,7);/q;;+2/p-2/t5-,6-;;/m1../s1.
What are the key properties of hydroxy-[[hydroxy(oxido)phosphoryl]methyl]phosphinate;platinum(2+);trans-(1R,2R)-cyclohexane-1,2-diamine?
hydroxy-[[hydroxy(oxido)phosphoryl]methyl]phosphinate;platinum(2+);trans-(1R,2R)-cyclohexane-1,2-diamine has a molecular weight of 483.26 g/mol, XLogP of -1.75, 2 rotatable bonds, 4 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for hydroxy-[[hydroxy(oxido)phosphoryl]methyl]phosphinate;platinum(2+);trans-(1R,2R)-cyclohexane-1,2-diamine is sourced from PubChem (CID 11225437), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).