Cas no 1727-57-7 (Butanoic acid, 2,2,3-trimethyl-, methyl ester)
1727-57-7 structure
Product Name:Butanoic acid, 2,2,3-trimethyl-, methyl ester
CAS No:1727-57-7
MF:C8H16O2
MW:144.211442947388
CID:1355415
PubChem ID:12647089
Update Time:2025-04-20
Butanoic acid, 2,2,3-trimethyl-, methyl ester Chemical and Physical Properties
Names and Identifiers
-
- Butanoic acid, 2,2,3-trimethyl-, methyl ester
- 2,2,3-trimethylbutansaeuremethylester
- 1727-57-7
- SCHEMBL1629800
- 2,2,3-Trimethylbutanoic acid methyl ester
- DB-133993
- methyl 2,2,3-trimethylbutyrate
-
- Inchi： 1S/C8H16O2/c1-6(2)8(3,4)7(9)10-5/h6H,1-5H3
- InChI Key： QAFJFJSXHMISRW-UHFFFAOYSA-N
- SMILES： O(C)C(C(C)(C)C(C)C)=O
Computed Properties
- Exact Mass: 144.11508
- Monoisotopic Mass: 144.115029749g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 0
- Hydrogen Bond Acceptor Count: 2
- Heavy Atom Count: 10
- Rotatable Bond Count: 3
- Complexity: 125
- Covalently-Bonded Unit Count: 1
- Defined Atom Stereocenter Count: 0
- Undefined Atom Stereocenter Count : 0
- Defined Bond Stereocenter Count: 0
- Undefined Bond Stereocenter Count: 0
- XLogP3: 2.3
- Topological Polar Surface Area: 26.3?2
Experimental Properties
- PSA: 26.3
Butanoic acid, 2,2,3-trimethyl-, methyl ester Related Literature
-
Vishwesh Venkatraman,Marco Foscato,Vidar R. Jensen,Bj?rn K?re Alsberg J. Mater. Chem. A, 2015,3, 9851-9860
-
J. Matthew Kurley,Phillip W. Halstenberg,Abbey McAlister,Stephen Raiman,Richard T. Mayes RSC Adv., 2019,9, 25602-25608
-
Hongxia Li,Aikifa Raza,Qiaoyu Ge,Jin-You Lu,TieJun Zhang Soft Matter, 2020,16, 6841-6849
-
Dhirendra K. Chaudhary,Pramendra Kumar,Lokendra Kumar RSC Adv., 2016,6, 94731-94738
-
Ji-Ping Wei Nanoscale, 2015,7, 11815-11832
1727-57-7 (Butanoic acid, 2,2,3-trimethyl-, methyl ester) Related Products
- 10250-48-3(Methyl tert-Butylacetate)
- 2177-77-7(Methyl 2-methylvalerate)
- 711-01-3(1-Adamantanecarboxylic Acid Methyl Ester)
- 868-57-5(DL-2-Methylbutyric Acid Methyl Ester)
- 1459-95-6(Dimethyl adamantane-1,3-dicarboxylate)
- 32980-26-0(4-Methoxy-3,3-dimethyl-4-oxobutanoic acid)
- 19780-94-0(Dimethyl 2-methylhexanedioate)
- 332062-08-5(Fmoc-S-3-amino-4,4-diphenyl-butyric acid)
- 1270529-38-8(1,2,3,4,5,6-Hexahydro-[2,3]bipyridinyl-6-ol)
- 2680771-01-9(4-cyclopentyl-3-{(prop-2-en-1-yloxy)carbonylamino}butanoic acid)
Recommended suppliers
Hangzhou TSurgeX Pharmaceutical Technology Co., Ltd.
Gold Member
Audited Supplier
CN Supplier
Reagent
Hunan Well Medicine Synthesis Technology Co., Ltd.
Gold Member
Audited Supplier
CN Supplier
Reagent
上海嶸奧生物技術有限公司
Gold Member
Audited Supplier
CN Supplier
Reagent
TAIXING JOXIN BIO-TEC CO.,LTD.
Gold Member
Audited Supplier
CN Supplier
Bulk
煙臺朗裕新材料科技有限公司
Gold Member
Audited Supplier
CN Supplier
Reagent