Home Nitro Compounds 102692-40-0
102692-40-0,MFCD00024800
Catalog No.:AA00082R
102692-40-0 | 2-Propen-1-one, 1-(4-methylphenyl)-3-(4-nitrophenyl)-, (2E)-
Pack Size
Purity
Availability
Price(USD)
Quantity
  
1mg
>90%
2 weeks  
$517.00   $362.00
- +
5mg
>90%
2 weeks  
$538.00   $377.00
- +
10mg
>90%
2 weeks  
$581.00   $407.00
- +
500mg
>90%
2 weeks  
$1,361.00   $953.00
- +
1g
>90%
2 weeks  
$2,293.00   $1,605.00
- +
5g
>90%
2 weeks  
$7,885.00   $5,520.00
- +
  • Technical Information
  • Properties
  • Literature
  • Request for Quotation
  • Q & A
  • Technical Information
  • Properties
  • Literature
Technical Information
Catalog Number:
AA00082R
Chemical Name:
2-Propen-1-one, 1-(4-methylphenyl)-3-(4-nitrophenyl)-, (2E)-
CAS Number:
102692-40-0
Molecular Formula:
C16H13NO3
Molecular Weight:
267.2793
MDL Number:
MFCD00024800
IUPAC Name:
1-(4-methylphenyl)-3-(4-nitrophenyl)prop-2-en-1-one
InChI:
InChI=1S/C16H13NO3/c1-12-2-7-14(8-3-12)16(18)11-6-13-4-9-15(10-5-13)17(19)20/h2-11H,1H3
InChI Key:
VFNVMOXZNIOBKS-UHFFFAOYSA-N
SMILES:
Cc1ccc(cc1)C(=O)/C=C/c1ccc(cc1)[N+](=O)[O-]
Properties
Computed Properties
 
Complexity:
370  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
267.09g/mol
Formal Charge:
0
Heavy Atom Count:
20  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
267.284g/mol
Monoisotopic Mass:
267.09g/mol
Rotatable Bond Count:
3  
Topological Polar Surface Area:
62.9A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
1  
XLogP3:
3.3  

Synonyms
 
102692-40-0 
2-Propen-1-one, 1-(4-methylphenyl)-3-(4-nitrophenyl)-, (E)- 
13736-56-6 
3-(4-Nitrophenyl)-1-(p-tolyl)prop-2-en-1-one 
1-(4-methylphenyl)-3-(4-nitrophenyl)prop-2-en-1-one 
(E)-1-(4-methylphenyl)-3-(4-nitrophenyl)-2-propen-1-one 
ZINC05217261 
CID3543506 
4'-METHYL-4-NITROCHALCONE 
ACMC-20m5o8 
AC1MT1M4 
CTK0G7462 
DTXSID80393487 
KS-000021PF 
AKOS030240552 
MCULE-1324515327 
Literature
Quotation Request
Company Name:
*
Contact Person:
*
Email:
*
Quantity Required:
*
Additional Info:
Q & A