CAS RN: 99-75-2
Methyl p-Toluate
Product Availability
Choose a grade to view its available package options.
4 package records3 with current stock1 grade group
| Batch No. | Package | Availability | Warehouse | Lead Time | Inquiry |
|---|---|---|---|---|---|
| Batchno.20260224 | 100g | In stock | Shanghai, Shandong, Hebei | Inquiry | |
| Batchno.20250503 | 2.5kg | Out of stock | 5-7 business days | Inquiry | |
| Batchno.20250323 | 25g | In stock | Shanghai, Shandong, Chongqing, Hebei | Inquiry | |
| Batchno.20250818 | 500g | In stock | Shanghai, Shandong | Inquiry |
- Product code: SSC-212947
Historical Factory Record
Historical Supply Reference
This product has historical factory records. Recorded pack sizes and purity can be used as a supply reference, while project-specific availability is confirmed by inquiry.
- Pack sizes on record: 500g
- Available purity: ≥98%
- Inventory rows with stock: 0
- Bulk packaging: confirmed by inquiry
Reference Pack Sizes
Reference pack sizes are shown below. Final availability, packaging and delivery schedule are confirmed by inquiry.
| Pack Size | Recorded Purity | Available Qty | Ship From | Inquiry |
|---|---|---|---|---|
| 500g | ≥98% | 0 Out of Stock | Shanghai | Inquiry |
99-75-2 / methyl 4-methylbenzoate
Basic Information
CAS
99-75-2
Multi CAS
Yes
Molecular Formula
C9H10O2
Molecular Weight
150.170000
Exact Mass
150.068080
InChI
InChI=1S/C9H10O2/c1-7-3-5-8(6-4-7)9(10)11-2/h3-6H,1-2H3
InChIKey
QSSJZLPUHJDYKF-UHFFFAOYSA-N
Physical Properties
Melting Point
91 °F (NTP, 1992)
33.2 °C
Boiling Point
423 °F at 760 mmHg (NTP, 1992)
222.5 °C @ 760 MM HG
Density
1.058 at 77 °F (NTP, 1992) - Denser than water; will sink
1.058 @ 25 °C/15.6 °C
Physical Description
Opaque colorless to white shiny crystalline solid. Intense unpleasant odor. (NTP, 1992)
White solid; mp = 34 deg C; [Hawley] Colorless to white solid with a strong unpleasant odor; [CAMEO] Colorless crystalline solid; mp = 32-35 deg C
Appearance
CRYSTALS FROM AQ METHANOL OR PETROLEUM ETHER
WHITE CRYSTALLINE SOLID
State
Solid
Computed Properties
Structural Parameters
Heavy atom count
11
Aromatic heavy atom count
6
Fraction Csp3
0.22
Rotatable bonds
1
H-bond acceptors
2
Molar refractivity
42.52
TPSA
26.3
LogP / Solubility
WLOGP
1.78
MLOGP
1.56
XLogP3
2.7
Consensus LogP
2.01
Log S (ESOL)
-2.23
Class (ESOL)
Moderately soluble
Log S (Ali)
-2.08
Class (Ali)
Moderately soluble
Log S (SILICOS-IT)
-2.23
Class (SILICOS-IT)
Moderately 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)
-2.37
Drug-likeness / Medicinal Chemistry
Lipinski
Yes
Ghose
No
Veber
Yes
Egan
Yes
Muegge
No
Bioavailability score
0.55
Leadlikeness
No
Synthetic Accessibility
1.5
