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Substance Name: p-Anisic acid
RN: 100-09-4
UNII: 4SB6Y7DMM3
InChIKey: ZEYHEAKUIGZSGI-UHFFFAOYSA-N
Classification Code
- Drug / Therapeutic Agent
Molecular Formula
- C8-H8-O3
Molecular Weight
- 152.1482
- All
- Links to Resources
- Names & Synonyms
- Registry Numbers
- Structure Descriptors
- Toxicity
- Physical Properties
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Names and Synonyms
Name of Substance
- 4-Anisic acid
- Benzoic acid, 4-methoxy-
- p-Anisic acid
- p-Methoxybenzoic acid
Synonyms
- 4-10-00-00346 (Beilstein Handbook Reference)
- 4-Anisic acid
- 4-Methoxybenzoic acid
- AI3-00893
- Anisic acid, p-isomer
- ANISIC ACID, PARA
- BRN 0508910
- Draconic acid
- EINECS 202-818-5
- Kyselina 4-methoxybenzoova
- Kyselina 4-methoxybenzoova [Czech]
- NSC 32742
- p-Methoxybenzoic acid
- UNII-4SB6Y7DMM3
Systematic Names
- Benzoic acid, 4-methoxy-
- p-Anisic acid
- p-Methoxybenzoic acid
Registry Numbers
CAS Registry Number
- 100-09-4
FDA UNII
- 4SB6Y7DMM3
Related Registry Numbers
- 52509-81-6 (potassium)
- 536-45-8 (sodium)
- 73424-02-9 (copper+2)
System Generated Number
- 0000100094
Structure Descriptors
InChI
InChI=1S/C8H8O3/c1-11-7-4-2-6(3-5-7)8(9)10/h2-5H,1H3,(H,9,10)InChIKey
ZEYHEAKUIGZSGI-UHFFFAOYSA-NSmiles
COc1ccc(cc1)Toxicity
| Organism | Test Type | Route | Reported Dose (Normalized Dose) | Effect | Source |
|---|---|---|---|---|---|
| mouse | LD50 | subcutaneous | 400mg/kg (400mg/kg) | Cesko-Slovenska Farmacie. Vol. 31, Pg. 236, 1982. |
Physical Properties
| Physical Property | Value | Units | Temp (deg C) | Source |
|---|---|---|---|---|
| Melting Point | 185 | deg C | EXP | |
| Boiling Point | 276.5 | deg C | EXP | |
| pKa Dissociation Constant | 4.47 | (none) | 25 | EXP |
| log P (octanol-water) | 1.96 | (none) | EXP | |
| Water Solubility | 530 | mg/L | 37 | EXP |
| Vapor Pressure | 1.50E-03 | mm Hg | 25 | EST |
| Henry's Law Constant | 6.41E-09 | atm-m3/mole | 25 | EST |
| Atmospheric OH Rate Constant | 9.31E-12 | cm3/molecule-sec | 25 | EST |
Physical property data is provided to ChemIDplus by SRC, Inc.