Cas no 15706-73-7 (Butyl 2-methylbutyrate)
Butyl 2-methylbutyrate is an ester compound with the molecular formula C?H??O?, commonly used as a flavor and fragrance ingredient. It exhibits a fruity, apple-like aroma, making it valuable in food, beverage, and cosmetic applications. The compound is characterized by its high purity, stability, and low volatility, ensuring consistent performance in formulations. Its ester linkage provides excellent solubility in organic solvents, facilitating easy incorporation into various matrices. Butyl 2-methylbutyrate is synthesized through esterification, yielding a product with minimal impurities. Its compatibility with other aroma chemicals and resistance to oxidation enhance its utility in long-lasting fragrance blends. The compound is typically stored under inert conditions to maintain its integrity.
Butyl 2-methylbutyrate structure
Product Name:Butyl 2-methylbutyrate
CAS No:15706-73-7
MF:C9H18O2
MW:158.238023281097
MDL:MFCD00042902
CID:139471
Update Time:2025-06-08
Butyl 2-methylbutyrate Chemical and Physical Properties
Names and Identifiers
-
- Butanoic acid,2-methyl-, butyl ester
- N-Butyl 2-Methylbutyrate
- Butyl 2-methylbutyrate
- NATURAL 2-METHYL BUTYL BUTYRATE FEMA NO.--------
- utyl 2-methylbutyrate
- butyl 2-methylbutanoate
- Butanoic acid, 2-methyl-, butyl ester
- n-Butyl-2-methylbutyrate
- alpha-Butyl 2-methylbutylate
- butyl 2-methyl butyrate
- Butyric acid, 2-methyl-, butyl ester
- FEMA No. 3393
- butyl 2-methyl-butanoate
- n-Butyl-2-methylbutyrate (natural)
- n-Butyl 2-methyl butyrate
- BUTYL-2-METHYLBUTYRATE
- DSSTox_CID_27046
- DSSTox_RID_82067
-
- MDL： MFCD00042902
- Inchi： 1S/C9H18O2/c1-4-6-7-11-9(10)8(3)5-2/h8H,4-7H2,1-3H3
- InChI Key： OTKQNSSMCDLVQV-UHFFFAOYSA-N
- SMILES： CCCCOC(C(CC)C)=O
Computed Properties
- Exact Mass: 158.13100
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 0
- Hydrogen Bond Acceptor Count: 2
- Heavy Atom Count: 11
- Rotatable Bond Count: 6
- Complexity: 110
- Covalently-Bonded Unit Count: 1
- Defined Atom Stereocenter Count: 1
- Undefined Atom Stereocenter Count : 0
- Defined Bond Stereocenter Count: 0
- Undefined Bond Stereocenter Count: 0
- Surface Charge: 0
- XLogP3: 2.8
- Topological Polar Surface Area: 26.3
Experimental Properties
- Color/Form: Colorless light yellow liquid
- Density: 0.863?g/mL?at 25?°C(lit.)
- Melting Point: 174-176 °C
- Boiling Point: 173-176?°C/730?mmHg(lit.)
- Flash Point: Fahrenheit: 140 ° f
Celsius: 60 ° c - Refractive Index: n20/D 1.408-1.410
n20/D 1.409(lit.) - PSA: 26.30000
- LogP: 2.37580
- FEMA: 3393 | N-BUTYL 2-METHYLBUTYRATE
- Solubility: Not available
Butyl 2-methylbutyrate Security Information
-
Symbol:
- Signal Word：Warning
- Hazard Statement： H226-H411
- Warning Statement： P273
- Hazardous Material transportation number：UN 3272 3/PG 3
- WGK Germany：3
- Hazard Category Code： 51/53
- Safety Instruction： S61
-
Hazardous Material Identification：
- HazardClass：3.2
- PackingGroup：III
- Safety Term：3.2
- Packing Group：III
- Risk Phrases：R51/53
Butyl 2-methylbutyrate Pricemore >>
| Related Categories | No. | Product Name | Cas No. | Purity | Specification | Price | update time | Inquiry |
|---|---|---|---|---|---|---|---|---|
| SHANG HAI XIAN DING Biotechnology Co., Ltd. | B6101-25ML |
Butyl 2-Methylbutyrate |
15706-73-7 | 98.0%(GC) | 25ML |
￥260.0 | 2022-09-28 | |
| SHANG HAI XIAN DING Biotechnology Co., Ltd. | B6101-100ML |
Butyl 2-Methylbutyrate |
15706-73-7 | 98.0%(GC) | 100ML |
￥780.0 | 2022-09-28 | |
| SHANG HAI A LA DING SHENG HUA KE JI GU FEN Co., Ltd. | N303009-25g |
Butyl 2-methylbutyrate |
15706-73-7 | ≥98% | 25g |
￥35.90 | 2023-09-01 | |
| SHANG HAI A LA DING SHENG HUA KE JI GU FEN Co., Ltd. | N303009-100g |
Butyl 2-methylbutyrate |
15706-73-7 | ≥98% | 100g |
￥115.90 | 2023-09-01 | |
| abcr | AB549886-25 ml |
Butyl 2-Methylbutyrate; . |
15706-73-7 | 25 ml |
€50.10 | 2024-04-19 | ||
| abcr | AB549886-100 ml |
Butyl 2-Methylbutyrate; . |
15706-73-7 | 100 ml |
€110.70 | 2024-04-19 | ||
| SHANG HAI MAI KE LIN SHENG HUA Technology Co., Ltd. | N858717-1g |
N-Butyl 2-Methylbutyrate |
15706-73-7 | ≥98% | 1g |
￥26.00 | 2022-09-01 | |
| SHANG HAI MAI KE LIN SHENG HUA Technology Co., Ltd. | N858717-5g |
N-Butyl 2-Methylbutyrate |
15706-73-7 | ≥98% | 5g |
￥30.00 | 2022-09-01 | |
| SHANG HAI MAI KE LIN SHENG HUA Technology Co., Ltd. | N858717-25g |
N-Butyl 2-Methylbutyrate |
15706-73-7 | ≥98% | 25g |
￥36.00 | 2022-09-01 | |
| SHANG HAI JI ZHI SHENG HUA Technology Co., Ltd. | N54450-25g |
Utyl 2-methylbutyrate |
15706-73-7 | 25g |
￥318.0 | 2021-09-08 |
Butyl 2-methylbutyrate Related Literature
-
Joo Chuan Yeo,Kenry Lab Chip, 2016,16, 4082-4090
-
Ross Harder,David C. Dunand,Ian McNulty Nanoscale, 2017,9, 5686-5693
-
Nan Fu,Naphaporn Chiewchan,Xiao Dong Chen Food Funct., 2020,11, 211-220
-
Andreas Nenning,Manuel Holzmann,Jürgen Fleig,Alexander K. Opitz Mater. Adv., 2021,2, 5422-5431
-
Denis V. Korchagin,Elena A. Yureva,Alexander V. Akimov,Eugenii Ya. Misochko,Gennady V. Shilov,Artem D. Talantsev,Roman B. Morgunov,Alexander A. Shakin,Sergey M. Aldoshin,Boris S. Tsukerblat Dalton Trans., 2017,46, 7540-7548
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