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Substance Name: o-Anisaldehyde
RN: 135-02-4
UNII: 7CP821WF2W
InChIKey: PKZJLOCLABXVMC-UHFFFAOYSA-N
Classification Codes
- Mutation Data
- Skin / Eye Irritant
Molecular Formula
- C8-H8-O2
Molecular Weight
- 136.1492
- All
- Links to Resources
- Names & Synonyms
- Registry Numbers
- Structure Descriptors
- Toxicity
- Physical Properties
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Names and Synonyms
Name of Substance
- o-Anisaldehyde
Synonyms
- 2-Anisaldehyde
- 2-Methoxybenzaldehyde
- 2-Methoxybenzenecarboxaldehyde
- 2-Methoxyphenylformaldehyde
- 4-08-00-00180 (Beilstein Handbook Reference)
- 6-Methoxybenzaldehyde
- AI3-01375
- Benzaldehyde, 2-methoxy-
- Benzaldehyde, o-methoxy-
- BRN 0606301
- EINECS 205-171-7
- Formylanisole, o-
- NSC 58960
- o-Anisaldehyde
- o-Methoxybenzaldehyde
- Salicylaldehyde methyl ether
- UNII-7CP821WF2W
Systematic Names
- 2-Methoxybenzaldehyde
- Benzaldehyde, 2-methoxy-
- o-Anisaldehyde
Superlist Names
- 2-Methoxybenzaldehyde
- Benzaldehyde, 2-methoxy-
- o-Anisaldehyde
- o-Methoxybenzaldehyde
Registry Numbers
CAS Registry Number
- 135-02-4
FDA UNII
- 7CP821WF2W
System Generated Number
- 0000135024
Structure Descriptors
InChI
InChI=1S/C8H8O2/c1-10-8-5-3-2-4-7(8)6-9/h2-6H,1H3InChIKey
PKZJLOCLABXVMC-UHFFFAOYSA-NSmiles
COc1ccccc1C=OToxicity
| Organism | Test Type | Route | Reported Dose (Normalized Dose) | Effect | Source |
|---|---|---|---|---|---|
| mouse | LD50 | oral | 2400mg/kg (2400mg/kg) | BEHAVIORAL: SOMNOLENCE (GENERAL DEPRESSED ACTIVITY) GASTROINTESTINAL: CHANGES IN STRUCTURE OR FUNCTION OF SALIVARY GLANDS SENSE ORGANS AND SPECIAL SENSES: LACRIMATION: EYE | National Technical Information Service. Vol. OTS0533625, |
| rabbit | LD50 | skin | > 5gm/kg (5000mg/kg) | Food and Cosmetics Toxicology. Vol. 17, Pg. 855, 1979. | |
| rat | LD50 | oral | 2500mg/kg (2500mg/kg) | Food and Cosmetics Toxicology. Vol. 17, Pg. 855, 1979. |
Physical Properties
| Physical Property | Value | Units | Temp (deg C) | Source |
|---|---|---|---|---|
| Melting Point | 37.5 | deg C | EXP | |
| Boiling Point | 243.5 | deg C | EXP | |
| log P (octanol-water) | 1.72 | (none) | EXP | |
| Water Solubility | 2950 | mg/L | 25 | EST |
| Vapor Pressure | 0.121 | mm Hg | 25 | EST |
| Henry's Law Constant | 7.94E-07 | atm-m3/mole | 25 | EST |
| Atmospheric OH Rate Constant | 2.48E-11 | cm3/molecule-sec | 25 | EST |
Physical property data is provided to ChemIDplus by SRC, Inc.