Cas no 5408-76-4 (prop-1-ene-3,3-diyl (2E,2''E)bis-but-2-enoate)
5408-76-4 structure
Product Name:prop-1-ene-3,3-diyl (2E,2''E)bis-but-2-enoate
CAS No:5408-76-4
MF:C11H14O4
MW:210.226463794708
CID:939632
PubChem ID:5354387
Update Time:2025-04-19
prop-1-ene-3,3-diyl (2E,2''E)bis-but-2-enoate Chemical and Physical Properties
Names and Identifiers
-
- prop-1-ene-3,3-diyl (2E,2''E)bis-but-2-enoate
- 1-[(2E)-2-Butenoyloxy]-2-propenyl (2E)-2-butenoate
- 1-[(E)-but-2-enoyl]oxyprop-2-enyl (E)-but-2-enoate
- DTXSID30417788
- NSC8397
- 2-Butenoic acid, 2-propenylidene ester
- NSC-8397
- KVUPDWMFCGXHBN-NSLJXJERSA-N
- 5408-76-4
- 1-[(2E)-2-Butenoyloxy]-2-propenyl (2E)-2-butenoate #
- NSC 8397
-
- Inchi： 1S/C11H14O4/c1-4-7-9(12)14-11(6-3)15-10(13)8-5-2/h4-8,11H,3H2,1-2H3/b7-4+,8-5+
- InChI Key： KVUPDWMFCGXHBN-NSLJXJERSA-N
- SMILES： O(C(/C=C/C)=O)C(C=C)OC(/C=C/C)=O
Computed Properties
- Exact Mass: 210.08922
- Monoisotopic Mass: 210.089209
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 0
- Hydrogen Bond Acceptor Count: 4
- Heavy Atom Count: 15
- Rotatable Bond Count: 7
- Complexity: 263
- Covalently-Bonded Unit Count: 1
- Defined Atom Stereocenter Count: 0
- Undefined Atom Stereocenter Count : 0
- Defined Bond Stereocenter Count: 2
- Undefined Bond Stereocenter Count: 0
- Topological Polar Surface Area: 52.6
- XLogP3: 2.4
Experimental Properties
- Density: 1.052
- Boiling Point: 282°C at 760 mmHg
- Flash Point: 133.3°C
- Refractive Index: 1.476
- PSA: 52.6
- LogP: 1.73710
prop-1-ene-3,3-diyl (2E,2''E)bis-but-2-enoate Related Literature
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Yukiya Kitayama Polym. Chem., 2014,5, 2784-2792
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Chao-Han Cheng,Wen-Zhen Wang,Shie-Ming Peng,I-Chia Chen Phys. Chem. Chem. Phys., 2017,19, 25471-25477
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Tengfei Yu,Yuehan Wu,Wei Li,Bin Li RSC Adv., 2014,4, 34134-34143
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Xiaoming Liu,Zachary D. Hood,Wangda Li,Donovan N. Leonard,Arumugam Manthiram,Miaofang Chi J. Mater. Chem. A, 2021,9, 2111-2119
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