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CAS 185915-25-7 L-Menthyl lactate molecular structure lightbox
CAS RN: 185915-25-7

L-Menthyl lactate

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3 package records2 with current stock1 grade group
Batch No.PackageAvailabilityWarehouseLead TimeInquiry
Batchno.20251201 100g In stock Shanghai, Shandong Inquiry
Batchno.20250513 2.5kg Out of stock 5-7 business days Inquiry
Batchno.20250430 500g In stock Shandong Inquiry
  • Product code: starshine_CAS185915-25-7
  • Purity/Analytical Methods: >99.0%
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185915-25-7 / [(1R,2S,5R)-5-methyl-2-propan-2-ylcyclohexyl] 2-hydroxypropanoate

Standard CAS: 185915-25-7 Multi CAS: No
Basic Information Physical Properties Computed Properties

Basic Information

CAS
185915-25-7
Multi CAS
No
Molecular Formula
C13H24O3
Molecular Weight
228.330000
Exact Mass
228.172545
SMILES
C[C@@H]1CC[C@H]([C@@H](C1)OC(=O)C(C)O)C(C)C
InChI
InChI=1S/C13H24O3/c1-8(2)11-6-5-9(3)7-12(11)16-13(15)10(4)14/h8-12,14H,5-7H2,1-4H3/t9-,10?,11+,12-/m1/s1
InChIKey
UJNOLBSYLSYIBM-SGUBAKSOSA-N

Physical Properties

Melting Point
38 - 40 °C
Boiling Point
142.00 °C. @ 5.00 mm Hg
Physical Description
Solid
State
Solid

Computed Properties

Structural Parameters

Heavy atom count
16
Fraction Csp3
0.92
Rotatable bonds
3
H-bond acceptors
3
H-bond donors
1
Molar refractivity
62.9
TPSA
46.53

LogP / Solubility

WLOGP
2.37
MLOGP
2.09
XLogP3
3.3
Consensus LogP
2.59
Log S (ESOL)
-2.55
Class (ESOL)
Moderately soluble
Log S (Ali)
-3.14
Class (Ali)
Poorly soluble
Log S (SILICOS-IT)
-3.47
Class (SILICOS-IT)
Poorly soluble

ADME

GI absorption
High
BBB permeant
Yes
P-gp substrate
No
CYP1A2 inhibitor
No
CYP2C19 inhibitor
No
CYP2C9 inhibitor
No
CYP2D6 inhibitor
No
CYP3A4 inhibitor
No
Log Kp (skin permeation)
-2.43

Drug-likeness / Medicinal Chemistry

Lipinski
Yes
Ghose
No
Veber
Yes
Egan
Yes
Muegge
Yes
Bioavailability score
0.55
Leadlikeness
No
Synthetic Accessibility
3.5

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