Home Aldehydes 2-Nitrocinnamaldehyde

2-Nitrocinnamaldehyde

CAS No.:
1466-88-2
Catalog Number:
AG001E6G
Molecular Formula:
C9H7NO3
Molecular Weight:
177.1568
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
1g
98%
In Stock USA
United States
$13
- +
5g
98%
In Stock USA
United States
$25
- +
25g
98%
In Stock USA
United States
$94
- +
100g
98%
In Stock USA
United States
$325
- +
Product Description
Catalog Number:
AG001E6G
Chemical Name:
2-Nitrocinnamaldehyde
CAS Number:
1466-88-2
Molecular Formula:
C9H7NO3
Molecular Weight:
177.1568
MDL Number:
MFCD00007188
IUPAC Name:
(E)-3-(2-nitrophenyl)prop-2-enal
InChI:
InChI=1S/C9H7NO3/c11-7-3-5-8-4-1-2-6-9(8)10(12)13/h1-7H/b5-3+
InChI Key:
VMSMELHEXDVEDE-HWKANZROSA-N
SMILES:
O=CC=Cc1ccccc1[N+](=O)[O-]
EC Number:
215-988-0
NSC Number:
28458
Properties
Complexity:
219  
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:
1.4  
Properties