4-Pentenoicacid, 4-nitro-5-phenyl-, ethyl ester

Modify Date: 2025-09-18 11:21:56

4-Pentenoicacid, 4-nitro-5-phenyl-, ethyl ester Structure
4-Pentenoicacid, 4-nitro-5-phenyl-, ethyl ester structure
Common Name 4-Pentenoicacid, 4-nitro-5-phenyl-, ethyl ester
CAS Number 52175-26-5 Molecular Weight 249.26200
Density 1.172g/cm3 Boiling Point 378.3ºC at 760mmHg
Molecular Formula C13H15NO4 Melting Point N/A
MSDS N/A Flash Point 158.8ºC

 Names

Name ethyl (Z)-4-nitro-5-phenylpent-4-enoate

 Chemical & Physical Properties

Density 1.172g/cm3
Boiling Point 378.3ºC at 760mmHg
Molecular Formula C13H15NO4
Molecular Weight 249.26200
Flash Point 158.8ºC
Exact Mass 249.10000
PSA 72.12000
LogP 3.17070
Index of Refraction 1.556
InChIKey STGXHVBKOHDVJM-BENRWUELSA-N
SMILES CCOC(=O)CCC(=Cc1ccccc1)[N+](=O)[O-]

 Synthetic Route

~82%

4-Pentenoicacid, 4-nitro-5-phenyl-, ethyl ester Structure

4-Pentenoicacid...

CAS#:52175-26-5

Literature: Gaur, S. P.; Jain, Padam C.; Anand, Nitya Indian Journal of Chemistry, Section B: Organic Chemistry Including Medicinal Chemistry, 1982 , vol. 21, # 1 p. 46 - 51

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4-Pentenoicacid, 4-nitro-5-phenyl-, ethyl ester Structure

4-Pentenoicacid...

CAS#:52175-26-5

Literature: Kumar, Rahul; Namboothiri, Irishi N. N. Organic Letters, 2011 , vol. 13, # 15 p. 4016 - 4019
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