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CAS 43077-29-8 (S)-(+)-NEOMENTHYLDIPHENYLPHOSPHINE molecular structure lightbox
CAS RN: 43077-29-8

(S)-(+)-NEOMENTHYLDIPHENYLPHOSPHINE

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6 package records5 with current stock1 grade group
Batch No.PackageAvailabilityWarehouseLead TimeInquiry
Batchno.20250503 100mg In stock Shanghai Inquiry
Batchno.20250304 1g In stock Shanghai Inquiry
Batchno.20251112 250mg In stock Shanghai Inquiry
Batchno.20250703 25mg In stock Shanghai Inquiry
Batchno.20250604 25mg Out of stock 8-10 business days Inquiry
Batchno.20260627 50mg In stock Shanghai Inquiry
  • Product code: starshine_CAS43077-29-8
  • Purity/Analytical Methods: >99.0%
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43077-29-8 / [(1S,2S,5R)-5-methyl-2-propan-2-ylcyclohexyl]-diphenylphosphane

Standard CAS: 43077-29-8 Multi CAS: Yes
Basic Information Computed Properties

Basic Information

CAS
43077-29-8
Multi CAS
Yes
Molecular Formula
C22H29P
Molecular Weight
324.400000
Exact Mass
324.200688
InChI
InChI=1S/C22H29P/c1-17(2)21-15-14-18(3)16-22(21)23(19-10-6-4-7-11-19)20-12-8-5-9-13-20/h4-13,17-18,21-22H,14-16H2,1-3H3/t18-,21+,22+/m1/s1
InChIKey
BEYDOEXXFGNVRZ-COPCDDAFSA-N

Computed Properties

Structural Parameters

Heavy atom count
23
Aromatic heavy atom count
12
Fraction Csp3
0.45
Rotatable bonds
4
Molar refractivity
104.2
TPSA
0.0000

LogP / Solubility

WLOGP
5.58
MLOGP
4.93
XLogP3
6.5
Consensus LogP
5.67
Log S (ESOL)
-5.49
Class (ESOL)
Slightly soluble
Log S (Ali)
-6.25
Class (Ali)
Insoluble
Log S (SILICOS-IT)
-6.88
Class (SILICOS-IT)
Insoluble

ADME

GI absorption
High
BBB permeant
No
P-gp substrate
No
CYP1A2 inhibitor
Yes
CYP2C19 inhibitor
Yes
CYP2C9 inhibitor
Yes
CYP2D6 inhibitor
No
CYP3A4 inhibitor
No
Log Kp (skin permeation)
-0.74

Drug-likeness / Medicinal Chemistry

Lipinski
Yes
Ghose
Yes
Veber
Yes
Egan
Yes
Muegge
No
Bioavailability score
0.55
Brenk alerts
1
Leadlikeness
No
Synthetic Accessibility
4

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