Home Nitro Compounds 179174-16-4
179174-16-4,MFCD25970301
Catalog No.:AA01DYVX

179174-16-4 | (2E)-3-(4-nitrophenyl)but-2-enoic acid, E

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Technical Information
Catalog Number:
AA01DYVX
Chemical Name:
(2E)-3-(4-nitrophenyl)but-2-enoic acid, E
CAS Number:
179174-16-4
Molecular Formula:
C10H9NO4
Molecular Weight:
207.1828
MDL Number:
MFCD25970301
SMILES:
OC(=O)/C=C(/c1ccc(cc1)[N+](=O)[O-])\C
Properties
Computed Properties
 
Complexity:
284  
Covalently-Bonded Unit Count:
1  
Defined Bond Stereocenter Count:
1  
Heavy Atom Count:
15  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
1  
Rotatable Bond Count:
2  
XLogP3:
2.3  

Literature
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SDS
Tags:179174-16-4 Molecular Formula|179174-16-4 MDL|179174-16-4 SMILES|179174-16-4 (2E)-3-(4-nitrophenyl)but-2-enoic acid, E