CAS 12120-15-9 ETHYLENEBIS(TRIPHENYLPHOSPHINE)PLATINUM(0) molecular structure

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CAS RN: 12120-15-9

ETHYLENEBIS(TRIPHENYLPHOSPHINE)PLATINUM(0)

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3 package records1 with current stock1 grade group

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Batch No.	Package	Availability	Warehouse	Inquiry
Batchno.20251209	100mg	In stock	Shanghai	Inquiry
Batchno.20250312	1g	Out of stock		Inquiry
Batchno.20250522	250mg	Out of stock		Inquiry

Product code: starshine_CAS12120-15-9
Purity/Analytical Methods: >99.0%

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12120-15-9 / ethene;platinum;bis(triphenylphosphane)

Ethylenebis(triphenylphosphine)platinum(0) | DTXSID501338570 | RefChem:596709

Standard CAS: 12120-15-9 Multi CAS: Yes

Basic Information Computed Properties Safety & Transport

Basic Information

CAS

12120-15-9

Multi CAS

Yes

Molecular Formula

C38H34P2Pt

Molecular Weight

747.700000

Exact Mass

747.178369

SMILES

C=C.C1=CC=C(C=C1)P(C2=CC=CC=C2)C3=CC=CC=C3.C1=CC=C(C=C1)P(C2=CC=CC=C2)C3=CC=CC=C3.[Pt]

InChI

InChI=1S/2C18H15P.C2H4.Pt/c2*1-4-10-16(11-5-1)19(17-12-6-2-7-13-17)18-14-8-3-9-15-18;1-2;/h2*1-15H;1-2H2;

InChIKey

RZUASTIKPBCXPU-UHFFFAOYSA-N

Synonyms

Ethylenebis(triphenylphosphine)platinum(0) DTXSID501338570 RefChem:596709 DTXCID801768566 623-241-9

Computed Properties

Structural Parameters

Heavy atom count

Aromatic heavy atom count

Rotatable bonds

Molar refractivity

181.55

TPSA

0.0000

LogP / Solubility

WLOGP

7.69

MLOGP

6.83

XLogP3

7.69

Consensus LogP

7.4

Log S (ESOL)

-9.57

Class (ESOL)

Insoluble

Log S (Ali)

-11.24

Class (Ali)

Insoluble

Log S (SILICOS-IT)

-11.62

Class (SILICOS-IT)

Insoluble

ADME

GI absorption

Low

BBB permeant

P-gp substrate

CYP1A2 inhibitor

CYP2C19 inhibitor

Yes

CYP2C9 inhibitor

Yes

CYP2D6 inhibitor

CYP3A4 inhibitor

Yes

Log Kp (skin permeation)

-1.82

Drug-likeness / Medicinal Chemistry

Lipinski

Ghose

Veber

Yes

Egan

Muegge

Bioavailability score

0.17

Brenk alerts

Leadlikeness

Synthetic Accessibility

5.5

Safety & Transport

Pictogram(s)

Irritant

Signal

Warning

GHS Hazard Statements

H315 (100%): Causes skin irritation [Warning Skin corrosion/irritation] H319 (100%): Causes serious eye irritation [Warning Serious eye damage/eye irritation] H335 (100%): May cause respiratory irritation [Warning Specific target organ toxicity, single exposure; Respiratory tract irritation]

Precautionary Statement Codes

P261, P264, P264+P265, P271, P280, P302+P352, P304+P340, P305+P351+P338, P319, P321, P332+P317, P337+P317, P362+P364, P403+P233, P405, and P501