CAS RN: 1135-15-5
3-(3-HYDROXY-4-METHOXYPHENYL)PROPIONIC ACID
Product Availability
Choose a grade to view its available package options.
3 package records2 with current stock3 grade groups
| Batch No. | Package | Availability | Warehouse | Lead Time | Inquiry |
|---|---|---|---|---|---|
| Batchno.20260601 | 100mg / 250mg / 1g | Confirm by inquiry | Shanghai, Shandong | 5-7 business days | Inquiry |
| Batch No. | Package | Availability | Warehouse | Lead Time | Inquiry |
|---|---|---|---|---|---|
| Batchno.20260623 | 100mg | Out of stock | 8-10 business days | Inquiry |
| Batch No. | Package | Availability | Warehouse | Lead Time | Inquiry |
|---|---|---|---|---|---|
| Batchno.20250720 | 100mg / 250mg / 1g | Confirm by inquiry | Shandong | 8-10 business days | Inquiry |
- Product code: starshine_CAS1135-15-5
- Purity/Analytical Methods: >99.0%
1135-15-5 / 3-(3-hydroxy-4-methoxyphenyl)propanoic acid
3-(3-HYDROXY-4-METHOXYPHENYL)PROPIONIC ACID | 3-Hydroxy-4-methoxybenzenepropanoic acid | Hydroisoferulic Acid
Basic Information
CAS
1135-15-5
Multi CAS
No
Molecular Formula
C10H12O4
Molecular Weight
196.200000
Exact Mass
196.073559
SMILES
COC1=C(C=C(C=C1)CCC(=O)O)O
InChI
InChI=1S/C10H12O4/c1-14-9-4-2-7(6-8(9)11)3-5-10(12)13/h2,4,6,11H,3,5H2,1H3,(H,12,13)
InChIKey
ZVIJTQFTLXXGJA-UHFFFAOYSA-N
Synonyms
3-(3-HYDROXY-4-METHOXYPHENYL)PROPIONIC ACID
3-Hydroxy-4-methoxybenzenepropanoic acid
Hydroisoferulic Acid
Benzenepropanoic acid, 3-hydroxy-4-methoxy-
UNII-4AC7M5U2UE
Computed Properties
Structural Parameters
Heavy atom count
14
Aromatic heavy atom count
6
Fraction Csp3
0.3
Rotatable bonds
4
H-bond acceptors
3
H-bond donors
2
Molar refractivity
50.62
TPSA
66.76
LogP / Solubility
WLOGP
1.42
MLOGP
1.25
XLogP3
0.7
Consensus LogP
1.12
Log S (ESOL)
-2
Class (ESOL)
Moderately soluble
Log S (Ali)
-2.19
Class (Ali)
Moderately soluble
Log S (SILICOS-IT)
-2.59
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)
-2.91
Drug-likeness / Medicinal Chemistry
Lipinski
Yes
Ghose
No
Veber
Yes
Egan
Yes
Muegge
No
Bioavailability score
0.55
Leadlikeness
No
Synthetic Accessibility
1.5
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
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