Home Aldehydes 4-Nitrocinnamaldehyde

4-Nitrocinnamaldehyde

CAS No.:
49678-08-2
Catalog Number:
AG003LVE
Molecular Formula:
C9H7NO3
Molecular Weight:
177.1568
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
1g
95%
In Stock USA
United States
$63
- +
5g
95%
In Stock USA
United States
$188
- +
Product Description
Catalog Number:
AG003LVE
Chemical Name:
4-Nitrocinnamaldehyde
CAS Number:
49678-08-2
Molecular Formula:
C9H7NO3
Molecular Weight:
177.1568
MDL Number:
MFCD00007379
IUPAC Name:
(E)-3-(4-nitrophenyl)prop-2-enal
InChI:
InChI=1S/C9H7NO3/c11-7-1-2-8-3-5-9(6-4-8)10(12)13/h1-7H/b2-1+
InChI Key:
ALGQVMMYDWQDEC-OWOJBTEDSA-N
SMILES:
O=C/C=C/c1ccc(cc1)[N+](=O)[O-]
EC Number:
217-076-8
UNII:
48R8LAM7YX
NSC Number:
1318
Properties
Complexity:
211  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
1  
Exact Mass:
177.043g/mol
Formal Charge:
0
Heavy Atom Count:
13  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
177.159g/mol
Monoisotopic Mass:
177.043g/mol
Rotatable Bond Count:
2  
Topological Polar Surface Area:
62.9A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.5  
Properties