Cas no 10522-34-6 (Propanoic acid, 2-methyl-, nonyl ester)
10522-34-6 structure
Product Name:Propanoic acid, 2-methyl-, nonyl ester
CAS No:10522-34-6
MF:C13H26O2
MW:214.344344615936
CID:95934
PubChem ID:517863
Update Time:2025-04-18
Propanoic acid, 2-methyl-, nonyl ester Chemical and Physical Properties
Names and Identifiers
-
- Propanoic acid, 2-methyl-, nonyl ester
- nonyl 2-methylpropanoate
- Nonyl 2-methylpropanoate #
- SXMUYNHMPAZLEB-UHFFFAOYSA-N
- DTXSID90333738
- Nonylisobutyrat
- 10522-34-6
- SCHEMBL2354508
-
- Inchi： 1S/C13H26O2/c1-4-5-6-7-8-9-10-11-15-13(14)12(2)3/h12H,4-11H2,1-3H3
- InChI Key： SXMUYNHMPAZLEB-UHFFFAOYSA-N
- SMILES： O(C(C(C)C)=O)CCCCCCCCC
Computed Properties
- Exact Mass: 214.19338
- Monoisotopic Mass: 214.193280068g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 0
- Hydrogen Bond Acceptor Count: 2
- Heavy Atom Count: 15
- Rotatable Bond Count: 10
- Complexity: 153
- 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: 5
- Topological Polar Surface Area: 26.3?2
Experimental Properties
- PSA: 26.3
Propanoic acid, 2-methyl-, nonyl ester Related Literature
-
Kunli Xu,Yuwen Yi,Jing Deng,Yuanhui Wang,Bo Zhao,Qianran Sun,Chenhui Gong,Zepeng Yang,Hailun Wan,Ruiyan He,Xinyu Wu,Bo Yao,Meichao Zhang,Yong Tang RSC Adv. 2022 12 11591
10522-34-6 (Propanoic acid, 2-methyl-, nonyl ester) Related Products
- 2349-07-7(Hexyl isobutyrate)
- 2050-01-3(Isoamyl Isobutyrate)
- 39255-32-8(Ethyl 2-methylpentanoate)
- 10032-15-2(Hexyl 2-methylbutanoate)
- 90397-38-9(2-Methylpentyl 2-methylvalerate)
- 105-79-3(isobutyl caproate)
- 646-13-9(isobutyl stearate)
- 97-87-0(butyl isobutyrate)
- 2983-38-2(Etzadroxil)
- 2445-69-4(2-Methylbutyl isobutyrate)
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