Cas no 100636-30-4 (2,4-Pentadienoyl chloride, 5-phenyl-, (2E,4E)-)
100636-30-4 structure
Product Name:2,4-Pentadienoyl chloride, 5-phenyl-, (2E,4E)-
CAS No:100636-30-4
MF:C11H9ClO
MW:192.641562223434
CID:1126130
PubChem ID:6450287
Update Time:2025-04-20
2,4-Pentadienoyl chloride, 5-phenyl-, (2E,4E)- Chemical and Physical Properties
Names and Identifiers
-
- 2,4-Pentadienoyl chloride, 5-phenyl-, (2E,4E)-
- 5-phenyl-2,4-pentadienoic acid chloride
- 100636-30-4
- 5-phenylpenta-2,4-dienoyl chloride
- 5-Phenyl-(2E,4E)-pentadienoyl chloride
- (2E,4E)-5-phenylpenta-2,4-dienoyl chloride
- 40926-86-1
- 2,4-Pentadienoyl chloride, 5-phenyl-
- SCHEMBL560726
-
- Inchi： 1S/C11H9ClO/c12-11(13)9-5-4-8-10-6-2-1-3-7-10/h1-9H/b8-4+,9-5+
- InChI Key： VBSYMODXUFYOLA-KBXRYBNXSA-N
- SMILES： ClC(/C=C/C=C/C1C=CC=CC=1)=O
Computed Properties
- Exact Mass: 135.99265
- Monoisotopic Mass: 192.0341926g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 0
- Hydrogen Bond Acceptor Count: 1
- Heavy Atom Count: 13
- Rotatable Bond Count: 3
- Complexity: 212
- 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
- XLogP3: 3.5
- Topological Polar Surface Area: 17.1?2
Experimental Properties
- PSA: 17.07
2,4-Pentadienoyl chloride, 5-phenyl-, (2E,4E)- Related Literature
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1. 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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Haitao Li,Yu Pan,Zhizhi Wang,Shan Chen,Ruixin Guo,Jianqiu Chen RSC Adv., 2015,5, 100775-100782
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Siquan Zhang,Shengyao Wang,Liping Guo,Hao Chen,Bien Tan,Shangbin Jin J. Mater. Chem. C, 2020,8, 192-200
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Priyambada Nayak,Tanmaya Badapanda,Anil Kumar Singh,Simanchalo Panigrahi RSC Adv., 2017,7, 16319-16331
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Hamid Heydari,Mohammad B. Gholivand New J. Chem., 2017,41, 237-244
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