Cas no 73052-17-2 (2-Propenoic acid,3-(2,6,6-trimethyl-2-cyclohexen-1-yl)-)
73052-17-2 structure
Product Name:2-Propenoic acid,3-(2,6,6-trimethyl-2-cyclohexen-1-yl)-
CAS No:73052-17-2
MF:C12H18O2
MW:194.270123958588
CID:575121
PubChem ID:5383965
Update Time:2025-04-19
2-Propenoic acid,3-(2,6,6-trimethyl-2-cyclohexen-1-yl)- Chemical and Physical Properties
Names and Identifiers
-
- 2-Propenoic acid,3-(2,6,6-trimethyl-2-cyclohexen-1-yl)-
- (E)-3-(2,6,6-trimethylcyclohex-2-en-1-yl)prop-2-enoic acid
- 3-(2,6,6-trimethyl-cyclohex-2-enyl)-acrylic acid
- 3-(2,6,6-Trimethyl-cyclohex-2-enyl)-acrylsaeure
- 3-< 2,4,4,-Trimethyl-cyclohexen-(1)-yl-(3)> -acrylsaeure
- AC1NTMBM
- Cyclocitrylidenessigsaeure
- NSC202766
- SureCN954794
- SCHEMBL954794
- 73052-17-2
- DTXSID10419467
- SCHEMBL954796
- NSC-202766
-
- Inchi: 1S/C12H18O2/c1-9-5-4-8-12(2,3)10(9)6-7-11(13)14/h5-7,10H,4,8H2,1-3H3,(H,13,14)/b7-6+
- InChI Key: MBPJEWGHOUWRLB-VOTSOKGWSA-N
- SMILES: OC(/C=C/C1C(C)=CCCC1(C)C)=O
Computed Properties
- Exact Mass: 194.13074
- Monoisotopic Mass: 194.130679813g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 1
- Hydrogen Bond Acceptor Count: 2
- Heavy Atom Count: 14
- Rotatable Bond Count: 2
- Complexity: 285
- Covalently-Bonded Unit Count: 1
- Defined Atom Stereocenter Count: 0
- Undefined Atom Stereocenter Count : 1
- Defined Bond Stereocenter Count: 1
- Undefined Bond Stereocenter Count: 0
- XLogP3: 2.8
- Topological Polar Surface Area: 37.3?2
Experimental Properties
- Density: 1.04
- Boiling Point: 302.8°C at 760 mmHg
- Flash Point: 208.2°C
- Refractive Index: 1.54
- PSA: 37.3
- LogP: 3.00970
2-Propenoic acid,3-(2,6,6-trimethyl-2-cyclohexen-1-yl)- Related Literature
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R. M. Pemberton,J. P. Hart,T. T. Mottram Analyst, 2001,126, 1866-1871
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Inês S. Albuquerque,Hélia F. Jeremias,Miguel Chaves-Ferreira,Dijana Matak-Vinkovic,Omar Boutureira,Carlos C. Rom?o Chem. Commun., 2015,51, 3993-3996
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Yaqing Liu,Jiangtao Ren,Jing Li,Jiyang Liu,Erkang Wang Chem. Commun., 2012,48, 802-804
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4. An amorphous lanthanum–iridium solid solution with an open structure for efficient water splitting?Wei Sun,Chenglong Ma,Xinlong Tian,Jianjun Liao,Ji Yang,Chengjun Ge,Weiwei Huang J. Mater. Chem. A, 2020,8, 12518-12525
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Huabin Zhang,Shaowu Du CrystEngComm, 2014,16, 4059-4068
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