CAS Number122-00-9
Synonyms1-(p-Tolyl)ethanone; Methyl p-tolyl ketone; 1-Acetyl-4-methylbenzene; p-Acetyltoluene; EINECS 204-514-8; Methyl 4-methylphenyl ketone; 1-p-Tolylethanone; 1-(4-Methylphenyl)ethanone; MFCD00000203; 1VR D1; 4-Acetyltoluene
Molecular FormulaCH3C6H4COCH3
Molecular Weight134.18
Purity95%
Density1.0±0.1 g/cm3
Boiling Point226 °C (lit.)
Melting Point22-24 °C (lit.)
AppearanceTransparent light yellow to yellow liquid
EINECS204-514-8
Symbol
Signal WordWarning
| Chemical & Physical Properties | |
|---|---|
| CAS Number | 122-00-9 |
| Catalog No. | 2A-9013545 |
| Chinese Name | 对甲基苯乙酮 |
| Synonyms | 1-(p-Tolyl)ethanone; Methyl p-tolyl ketone; 1-Acetyl-4-methylbenzene; p-Acetyltoluene; EINECS 204-514-8; Methyl 4-methylphenyl ketone; 1-p-Tolylethanone; 1-(4-Methylphenyl)ethanone; MFCD00000203; 1VR D1; 4-Acetyltoluene |
| Molecular Formula | CH3C6H4COCH3 |
| Molecular Weight | 134.18 |
| Purity | 95 |
| Density | 1.0±0.1 g/cm3 |
| Boiling Point | 226 °C (lit.) |
| Melting Point | 22-24 °C (lit.) |
| Appearance | Transparent light yellow to yellow liquid |
| Water Solubility | 0.37 g/L (15 ºC) |
| Storage Condition | Store in a cool place. |
| Application | 4′-methylacetophenone can be used as a flavoring agent and is widely present in volatile compounds in food and in certain natural compounds. |
| EINECS | 204-514-8 |
| HTC | 2914399090 |
| PubChem ID | 24896755 |
| MDL Number | MFCD00008751 |
| SMILES | CC(=O)c1ccc(C)cc1 |
| InChI | 1S/C9H10O/c1-7-3-5-9(6-4-7)8(2)10/h3-6H,1-2H3 |
| InChI Key | GNKZMNRKLCTJAY-UHFFFAOYSA-N |
| Beilstein/REAXYS | 606053 |
| NACRES Code | NA.22 |
| UNSPSC | 12352100 |
| Hazard Symbols | Transport |
| MSDS | msds/13545_1_122_00_9.pdf |
| Bioactivity | 4′-methylacetophenone can be used as a fragrance material. 4′-Methylacetophenone is wildly occurs in volatile compounds in food and in some natural complex substances (NCS)[1]. Related Catalog Research Areas >> Others Signaling Pathways >> Others >> Others References [1]. Api AM, et al. RIFM fragrance ingredient safety assessment, 4'-methylacetophenone, CAS Registry Number 122-00-9. Food Chem Toxicol. 2018 Dec;122 Suppl 1:S75-S83. Chemical & Physical Properties Density 1.0±0.1 g/cm3 Boiling Point 211.0±9.0 °C at 760 mmHg Melting Point 45-49 °C(lit.) Molecular Formula C9H10O Molecular Weight 134.175 Flash Point 92.2±0.0 °C Exact Mass 134.073166 PSA 17.07000 LogP 2.13 Vapour Pressure 0.2±0.4 mmHg at 25°C Index of Refraction 1.511 InChIKey GNKZMNRKLCTJAY-UHFFFAOYSA-N SMILES CC(=O)c1ccc(C)cc1 Water Solubility 0.37 g/L (15 ºC) |
| Use of | 4′-methylacetophenone can be used as a fragrance material. 4′-Methylacetophenone is wildly occurs in volatile compounds in food and in some natural complex substances (NCS)[1]. Properties Name 4'-Methylacetophenone Synonym More Synonyms 4'-Methylacetophenone Biological Activity Description 4′-methylacetophenone can be used as a fragrance material. 4′-Methylacetophenone is wildly occurs in volatile compounds in food and in some natural complex substances (NCS)[1]. Related Catalog Research Areas >> Others Signaling Pathways >> Others >> Others References [1]. Api AM, et al. RIFM fragrance ingredient safety assessment, 4'-methylacetophenone, CAS Registry Number 122-00-9. Food Chem Toxicol. 2018 Dec;122 Suppl 1:S75-S83. Chemical & Physical Properties Molecular Formula C9H10O Exact Mass 134.073166 PSA 17.07000 Index of Refraction 1.511 InChIKey GNKZMNRKLCTJAY-UHFFFAOYSA-N |
| Tax Rebate | 13.0% |
| Supervision | None. MFN tariff: 5.5%. Ordinary tariff: 30.0% |
| Transport Info | Shipping Name: UN |
| MSDS Transport Info | Module 14. Shipping information 14.1 UN dangerous goods number European Land Transport Dangerous Regulations: -International Maritime Dangerous Regulations: -International Air Transport Dangerous Regulations: - 14.2 United Nations shipping name European Land Transport Dangerous Regulations: Non-dangerous goods IMDG Code: Non-dangerous goods International air transport dangerous goods regulations: non-dangerous goods 14.3 Transport hazard categories European Land Transport Dangerous Regulations: -International Maritime Dangerous Regulations: -International Air Transport Dangerous Regulations: - 14.4 Package group European Land Transport Dangerous Regulations: -International Maritime Dangerous Regulations: -International Air Transport Dangerous Regulations: - 14.5 Environmental hazards European Land Transport Danger Regulations: No International Maritime Danger Regulations International Air Transport Danger Regulations: No Marine pollutants (yes/no): No 14.6 Special reminder to users No data available The above information is believed to be correct, but is not all-inclusive and should be used as a guide only. The information in this document is based on our current knowledge and is Correct safety instructions apply to this product. This information does not represent a warranty as to the properties of this product. See reverse side of invoice or packing slip. |
| Related Products in Specialty Chemicals | ||
|---|---|---|
| 4-Methoxybenzyl cyanide | 104-47-2 | 2A-9013537 |
| 4-Methoxythioanisole | 1879-16-9 | 2A-9013539 |
| 4-Methyl-2-pentanol | 108-11-2 | 2A-9013541 |
| 4-Methyl-2-pentanone | 108-10-1 | 2A-9013542 |
| 4-Methyl-3-nitrobenzoic acid | 96-98-0 | 2A-9013543 |
| 4-Methylaniline | 106-49-0 | 2A-9013546 |
| 4-Methylanisole | 104-93-8 | 2A-9013547 |
| 4-Methylbenzenesulfonic acid | 104-15-4 | 2A-9013549 |
| 4-Methylbenzonitrile | 104-85-8 | 2A-9013550 |
| 4-Methylcyclohexanol | 589-91-3 | 2A-9013551 |
| Browse all Specialty Chemicals products » | ||
Phone:
630-322-8886
630-322-8887
Email:
Office Locations:
Chicago, IL, USA
San Francisco, CA, USA
EN
SDS