Cas no 172495-33-9 (2-Propenoic acid, 3-iodo-, ethyl ester)
172495-33-9 structure
Product Name:2-Propenoic acid, 3-iodo-, ethyl ester
CAS No:172495-33-9
MF:C5H7IO2
MW:226.012354135513
CID:1355262
PubChem ID:639791
Update Time:2025-04-20
2-Propenoic acid, 3-iodo-, ethyl ester Chemical and Physical Properties
Names and Identifiers
-
- 2-Propenoic acid, 3-iodo-, ethyl ester
- J-018570
- AELYFQSZXFFNGP-ONEGZZNKSA-N
- A5754
- DB-327906
- Ethyl 3-iodo-2E-propenoate
- CHEBI:187432
- Ethyl 3-iodoacrylate
- J-521291
- Ethyl cis-3-iodoacrylate
- (E)-ethyl-3-iodoacrylate
- Ethyl (E)-3-iodoacrylate
- 2-Propenoic acid, 3-iodo-, ethyl ester, (2E)-
- ethyl (E)-3-iodoprop-2-enoate
- Ethyl 3-iodo-2E-acrylate
- I0502
- AKOS015853613
- AM805822
- DS-4795
- 31930-37-7
- 31930-36-6
- Ethyl(E)-3-iodoacrylate
- 172495-33-9
- LMFA01090138
- CS-W006336
- (E)-ETHYL 3-IODOACRYLATE
- MFCD11519164
- (E)-3-iodo-prop-2-enoic-acid ethyl ester
-
- Inchi： 1S/C5H7IO2/c1-2-8-5(7)3-4-6/h3-4H,2H2,1H3/b4-3+
- InChI Key： AELYFQSZXFFNGP-ONEGZZNKSA-N
- SMILES： I/C=C/C(=O)OCC
Computed Properties
- Exact Mass: 225.94861
- Monoisotopic Mass: 225.949
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 0
- Hydrogen Bond Acceptor Count: 2
- Heavy Atom Count: 8
- Rotatable Bond Count: 3
- Complexity: 98.6
- 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
- Topological Polar Surface Area: 26.3A^2
- XLogP3: 1.6
Experimental Properties
- PSA: 26.3
2-Propenoic acid, 3-iodo-, ethyl ester Related Literature
-
Xing Zhao,Lu Bai,Rui-Ying Bao,Zheng-Ying Liu,Ming-Bo Yang,Wei Yang RSC Adv., 2017,7, 46297-46305
-
Shintaro Takata,Yoshihiro Miura Phys. Chem. Chem. Phys., 2014,16, 24784-24789
-
Joseph H. Bisesi,Tara Sabo-Attwood Environ. Sci.: Nano, 2014,1, 574-583
-
Qiyuan Wu,Shangmin Xiong,Peichuan Shen,Shen Zhao,Alexander Orlov Catal. Sci. Technol., 2015,5, 2059-2064
172495-33-9 (2-Propenoic acid, 3-iodo-, ethyl ester) Related Products
- 31930-36-6(Ethyl Cis-\u200b3-\u200biodoacrylate)
- 31930-37-7((E)-Ethyl 3-iodoacrylate)
- 6213-88-3(methyl (2E)-3-iodoprop-2-enoate)
- 6214-23-9((Z)-3-Iodopropenoic Acid Methyl Ester 95/5 Z/E)
- 2098070-20-1(2-(3-(Pyridin-3-yl)-1H-pyrazol-1-yl)acetimidamide)
- 2680771-01-9(4-cyclopentyl-3-{(prop-2-en-1-yloxy)carbonylamino}butanoic acid)
- 1444113-98-7(N-(3-cyanothiolan-3-yl)-2-[(2,2,2-trifluoroethyl)sulfanyl]pyridine-4-carboxamide)
- 332062-08-5(Fmoc-S-3-amino-4,4-diphenyl-butyric acid)
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