Cas no 112156-73-7 (methyl 2-propylhex-2-enoate)
methyl 2-propylhex-2-enoate structure
Product Name:methyl 2-propylhex-2-enoate
CAS No:112156-73-7
MF:C10H18O2
MW:170.248723506927
CID:2608146
PubChem ID:71336143
Update Time:2025-04-21
methyl 2-propylhex-2-enoate Chemical and Physical Properties
Names and Identifiers
-
- methyl 2-propylhex-2-enoate
- DTXSID30764002
- 112156-73-7
-
- Inchi： 1S/C10H18O2/c1-4-6-8-9(7-5-2)10(11)12-3/h8H,4-7H2,1-3H3
- InChI Key： DLMUYZKLHGZDRW-UHFFFAOYSA-N
- SMILES： O(C)C(C(=CCCC)CCC)=O
Computed Properties
- Exact Mass: 170.130679813Da
- Monoisotopic Mass: 170.130679813Da
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 0
- Hydrogen Bond Acceptor Count: 2
- Heavy Atom Count: 12
- Rotatable Bond Count: 6
- Complexity: 159
- Covalently-Bonded Unit Count: 1
- Defined Atom Stereocenter Count: 0
- Undefined Atom Stereocenter Count : 0
- Defined Bond Stereocenter Count: 0
- Undefined Bond Stereocenter Count: 1
- XLogP3: 3.3
- Topological Polar Surface Area: 26.3?2
methyl 2-propylhex-2-enoate Related Literature
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J. Matthew Kurley,Phillip W. Halstenberg,Abbey McAlister,Stephen Raiman,Richard T. Mayes RSC Adv., 2019,9, 25602-25608
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Zhixia Liu,Tingjian Chen,Floyd E. Romesberg Chem. Sci., 2017,8, 8179-8182
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Jason Wan Lab Chip, 2020,20, 4528-4538
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Partha Laskar,Christine Dufès Nanoscale Adv., 2021,3, 6007-6026
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