Cas no 5079-90-3 (Benzoic acid,2-[(1E)-2-phenylethenyl]-)
![Benzoic acid,2-[(1E)-2-phenylethenyl]- structure](https://ossimg.kuujia.com/scimg/5500/5079-90-3x500.png)
5079-90-3 structure
Product Name:Benzoic acid,2-[(1E)-2-phenylethenyl]-
CAS No:5079-90-3
MF:C15H12O2
MW:224.254584312439
CID:381108
PubChem ID:826316
Update Time:2025-04-19
Benzoic acid,2-[(1E)-2-phenylethenyl]- Chemical and Physical Properties
Names and Identifiers
-
- Benzoic acid,2-[(1E)-2-phenylethenyl]-
- 2-[(E)-2-phenylethenyl]benzoic acid
- (E)-2-styrylbenzoic acid
- 2-((E)-styryl)benzoic acid
- 2-((E)-syryl)benzoic acid
- 2-(2-phenylethenyl)benzoic acid
- 2-(2-phenylvinyl)benzoic acid
- 2-[(E)-2-phenylethenyl]carboxylic acid
- AC1LGSPF
- AE-641
- Benzoic acid, 2-(2-phenylethenyl)-
- NSC143605
- Stilbene-2-carboxylic acid
- SureCN2291774
- SCHEMBL1019981
- (E)-2-stilbenecarboxylic acid
- UNII-S601S8Z806
- 2-Stilbenecarboxylic acid, trans-
- NSC-143605
- trans-2-Stilbenecarboxylic acid
- (E)-2-(2-Phenylethenyl)benzoic acid
- 2-Stilbenecarboxylic acid
- 2-[(E)-2-Phenylethenyl]benzoic acid #
- Q27288703
- SCHEMBL2291774
- 2-Styrylbenzoic acid
- Benzoic acid, 2-((1E)-2-phenylethenyl)-
- O11QCO6ESS
- (E)-o-stilbenecarboxylic acid
- NS00059769
- AE-641/00133053
- 60901-21-5
- UNII-O11QCO6ESS
- 5079-90-3
- MGJDPQKVELOHMT-ZHACJKMWSA-N
- AKOS005067401
- o-Stilbenecarboxylic acid
- S601S8Z806
- 2-Stilbenecarboxylic acid, (E)-
-
- Inchi： 1S/C15H12O2/c16-15(17)14-9-5-4-8-13(14)11-10-12-6-2-1-3-7-12/h1-11H,(H,16,17)/b11-10+
- InChI Key： MGJDPQKVELOHMT-ZHACJKMWSA-N
- SMILES： OC(C1C=CC=CC=1/C=C/C1C=CC=CC=1)=O
Computed Properties
- Exact Mass: 224.08376
- Monoisotopic Mass: 224.083729621g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 1
- Hydrogen Bond Acceptor Count: 2
- Heavy Atom Count: 17
- Rotatable Bond Count: 3
- Complexity: 277
- Covalently-Bonded Unit Count: 1
- Defined Atom Stereocenter Count: 0
- Undefined Atom Stereocenter Count : 0
- Defined Bond Stereocenter Count: 1
- Undefined Bond Stereocenter Count: 0
- XLogP3: 3.5
- Topological Polar Surface Area: 37.3?2
Experimental Properties
- PSA: 37.3
- LogP: 3.55520
Benzoic acid,2-[(1E)-2-phenylethenyl]- Related Literature
-
Gloria Belén Ramírez-Rodríguez,José Manuel Delgado-López,Jaime Gómez-Morales CrystEngComm, 2013,15, 2206-2212
-
Jason Wan Lab Chip, 2020,20, 4528-4538
-
Gang Pan,Yi-jie Bao,Jie Xu,Tao Liu,Cheng Liu,Yan-yan Qiu,Xiao-jing Shi,Hui Yu,Ting-ting Jia,Xia Yuan,Ze-ting Yuan,Yi-jun Cao RSC Adv., 2016,6, 42109-42119
-
Abdelaziz Houmam,Emad M. Hamed Chem. Commun., 2012,48, 11328-11330
-
Yi Cao,Yujiao Xiahou,Lixiang Xing,Xiang Zhang,Hong Li,ChenShou Wu,Haibing Xia Nanoscale, 2020,12, 20456-20466
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