tetrakis((3S)-3,7-dimethyloctan-1-amine);platinum(2+);tetrachloroplatinum(2-)

C40H92Cl4N4Pt2 — CID 173193055

IUPACtetrakis((3S)-3,7-dimethyloctan-1-amine);platinum(2+);tetrachloroplatinum(2-)
SMILESCC(C)CCC[C@H](C)CCN.CC(C)CCC[C@H](C)CCN.CC(C)CCC[C@H](C)CCN.CC(C)CCC[C@H](C)CCN.Cl[Pt-2](Cl)(Cl)Cl.[Pt+2]
InChIInChI=1S/4C10H23N.4ClH.2Pt/c4*1-9(2)5-4-6-10(3)7-8-11;;;;;;/h4*9-10H,4-8,11H2,1-3H3;4*1H;;/q;;;;;;;;2*+2/p-4/t4*10-;;;;;;/m0000....../s1
InChIKeyBQVWKLUTCIZFTH-LJEFYUKSSA-J
MW1161.17 g/mol
LogP13.94
Rot. Bonds24

About tetrakis((3S)-3,7-dimethyloctan-1-amine);platinum(2+);tetrachloroplatinum(2-)

tetrakis((3S)-3,7-dimethyloctan-1-amine);platinum(2+);tetrachloroplatinum(2-) (PubChem CID 173193055) has the molecular formula C40H92Cl4N4Pt2 and a molecular weight of 1161.17 g/mol. Its IUPAC name is tetrakis((3S)-3,7-dimethyloctan-1-amine);platinum(2+);tetrachloroplatinum(2-).

Molecular Properties

Compound Nametetrakis((3S)-3,7-dimethyloctan-1-amine);platinum(2+);tetrachloroplatinum(2-)
PubChem CID173193055
Molecular FormulaC40H92Cl4N4Pt2
Molecular Weight1161.17 g/mol
Exact Mass1158.54
IUPAC Nametetrakis((3S)-3,7-dimethyloctan-1-amine);platinum(2+);tetrachloroplatinum(2-)
SMILESCC(C)CCC[C@H](C)CCN.CC(C)CCC[C@H](C)CCN.CC(C)CCC[C@H](C)CCN.CC(C)CCC[C@H](C)CCN.Cl[Pt-2](Cl)(Cl)Cl.[Pt+2]
InChIInChI=1S/4C10H23N.4ClH.2Pt/c4*1-9(2)5-4-6-10(3)7-8-11;;;;;;/h4*9-10H,4-8,11H2,1-3H3;4*1H;;/q;;;;;;;;2*+2/p-4/t4*10-;;;;;;/m0000....../s1
InChIKeyBQVWKLUTCIZFTH-LJEFYUKSSA-J
XLogP13.94
TPSA104.08 Ų
H-Bond Donors4
H-Bond Acceptors4
Rotatable Bonds24
Heavy Atoms50
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 5001161.17
LogP ≤ 513.94
H-Bond Donors ≤ 54
H-Bond Acceptors ≤ 104

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Related Compounds

(3R)-3,7-dimethyloctan-1-amine
CID 92974894
(3R)-3,11-dimethyldodecan-1-amine
CID 118054380
(2S)-2,6-dimethylheptan-1-amine
CID 13329794
2,5,9,13-tetramethyltetradecane
CID 58292409
3-methyl-N'-(7-methyloctyl)hexane-1,6-diamine
CID 107815689
4,7-dimethyloctan-1-amine
CID 123439711
CID 175745189
CID 175745189
2,6,10,14,18,22,26-heptamethyloctacosane
CID 6428605
3-methylpentadecan-1-amine
CID 57147657
3,8,9-trimethyldecan-1-amine
CID 155084510
2,6,10,14,19,23-hexamethylhexacosane
CID 6428620
2,6,10,14,19-pentamethyltetracosane
CID 6428632

Frequently Asked Questions

What is the IUPAC name of tetrakis((3S)-3,7-dimethyloctan-1-amine);platinum(2+);tetrachloroplatinum(2-)?
The IUPAC name of tetrakis((3S)-3,7-dimethyloctan-1-amine);platinum(2+);tetrachloroplatinum(2-) (CID 173193055) is tetrakis((3S)-3,7-dimethyloctan-1-amine);platinum(2+);tetrachloroplatinum(2-).
What is the SMILES notation for tetrakis((3S)-3,7-dimethyloctan-1-amine);platinum(2+);tetrachloroplatinum(2-)?
The canonical SMILES for tetrakis((3S)-3,7-dimethyloctan-1-amine);platinum(2+);tetrachloroplatinum(2-) is CC(C)CCC[C@H](C)CCN.CC(C)CCC[C@H](C)CCN.CC(C)CCC[C@H](C)CCN.CC(C)CCC[C@H](C)CCN.Cl[Pt-2](Cl)(Cl)Cl.[Pt+2].
What is the InChIKey of tetrakis((3S)-3,7-dimethyloctan-1-amine);platinum(2+);tetrachloroplatinum(2-)?
The InChIKey is BQVWKLUTCIZFTH-LJEFYUKSSA-J. The full InChI is InChI=1S/4C10H23N.4ClH.2Pt/c4*1-9(2)5-4-6-10(3)7-8-11;;;;;;/h4*9-10H,4-8,11H2,1-3H3;4*1H;;/q;;;;;;;;2*+2/p-4/t4*10-;;;;;;/m0000....../s1.
What are the key properties of tetrakis((3S)-3,7-dimethyloctan-1-amine);platinum(2+);tetrachloroplatinum(2-)?
tetrakis((3S)-3,7-dimethyloctan-1-amine);platinum(2+);tetrachloroplatinum(2-) has a molecular weight of 1161.17 g/mol, XLogP of 13.94, 24 rotatable bonds, 4 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for tetrakis((3S)-3,7-dimethyloctan-1-amine);platinum(2+);tetrachloroplatinum(2-) is sourced from PubChem (CID 173193055), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).