Home Aldehydes 66894-06-2
66894-06-2,MFCD00007188
Catalog No.:AA003UTS

66894-06-2 | trans-2-Nitrocinnamaldehyde

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  • Technical Information
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Technical Information
Catalog Number:
AA003UTS
Chemical Name:
trans-2-Nitrocinnamaldehyde
CAS Number:
66894-06-2
Molecular Formula:
C9H7NO3
Molecular Weight:
177.1568
MDL Number:
MFCD00007188
SMILES:
O=C/C=C/c1ccccc1[N+](=O)[O-]
Properties
Properties
 
Form:
Solid  
MP:
127-129℃(lit.)  

Computed Properties
 
Complexity:
219  
Covalently-Bonded Unit Count:
1  
Heavy Atom Count:
13  
Hydrogen Bond Acceptor Count:
3  
Rotatable Bond Count:
2  
Undefined Bond Stereocenter Count:
1  
XLogP3:
1.4  

Literature

Title: (E)-2,2'-[3-(2-Nitro-phen-yl)prop-2-ene-1,1-di-yl]bis-(3-hy-droxy-cyclo-hex-2-en-1-one).

Journal: Acta crystallographica. Section E, Structure reports online 20120101

Title: (E)-2,2'-[3-(2-Nitro-phen-yl)prop-2-ene-1,1-di-yl]bis-(3-hy-droxy-5,5-dimethyl-cyclo-hex-2-en-1-one).

Journal: Acta crystallographica. Section E, Structure reports online 20111201

Title: Structure-activity relationship of cinnamaldehyde analogs as inhibitors of AI-2 based quorum sensing and their effect on virulence of Vibrio spp.

Journal: PloS one 20110101

Title: Organocatalytic asymmetric robinson annulation of alpha,beta-unsaturated aldehydes: applications to the total synthesis of (+)-palitantin.

Journal: The Journal of organic chemistry 20071026

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Tags:66894-06-2 Molecular Formula|66894-06-2 MDL|66894-06-2 SMILES|66894-06-2 trans-2-Nitrocinnamaldehyde