Home Nitriles 3,4,5-Trimethoxybenzonitrile

3,4,5-Trimethoxybenzonitrile

CAS No.:
1885-35-4
Catalog Number:
AG002GXN
Molecular Formula:
C10H11NO3
Molecular Weight:
193.1992
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
1g
97%(GC)
In Stock USA
United States
$44
- +
5g
97%(GC)
In Stock USA
United States
$60
- +
25g
97%(GC)
In Stock USA
United States
$185
- +
Product Description
Catalog Number:
AG002GXN
Chemical Name:
3,4,5-Trimethoxybenzonitrile
CAS Number:
1885-35-4
Molecular Formula:
C10H11NO3
Molecular Weight:
193.1992
MDL Number:
MFCD00001803
IUPAC Name:
3,4,5-trimethoxybenzonitrile
InChI:
InChI=1S/C10H11NO3/c1-12-8-4-7(6-11)5-9(13-2)10(8)14-3/h4-5H,1-3H3
InChI Key:
OSBQUSPVORCDCU-UHFFFAOYSA-N
SMILES:
COc1cc(C#N)cc(c1OC)OC
EC Number:
217-550-4
UNII:
GM6MN5DJ9R
NSC Number:
408924
Properties
Complexity:
209  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
193.074g/mol
Formal Charge:
0
Heavy Atom Count:
14  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
193.202g/mol
Monoisotopic Mass:
193.074g/mol
Rotatable Bond Count:
3  
Topological Polar Surface Area:
51.5A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.2  
Properties