Home Nitriles 2-Methoxy-5-methylbenzonitrile

2-Methoxy-5-methylbenzonitrile

CAS No.:
53078-70-9
Catalog Number:
AG003HJ9
Molecular Formula:
C9H9NO
Molecular Weight:
147.1739
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
1g
95%
In Stock USA
United States
$32
- +
5g
95%
In Stock USA
United States
$75
- +
10g
95%
In Stock USA
United States
$138
- +
25g
95%
In Stock USA
United States
$300
- +
Product Description
Catalog Number:
AG003HJ9
Chemical Name:
2-Methoxy-5-methylbenzonitrile
CAS Number:
53078-70-9
Molecular Formula:
C9H9NO
Molecular Weight:
147.1739
MDL Number:
MFCD03425693
IUPAC Name:
2-methoxy-5-methylbenzonitrile
InChI:
InChI=1S/C9H9NO/c1-7-3-4-9(11-2)8(5-7)6-10/h3-5H,1-2H3
InChI Key:
MYOASWSDRGHGLN-UHFFFAOYSA-N
SMILES:
N#Cc1cc(C)ccc1OC
Properties
Complexity:
170  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
147.068g/mol
Formal Charge:
0
Heavy Atom Count:
11  
Hydrogen Bond Acceptor Count:
2  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
147.177g/mol
Monoisotopic Mass:
147.068g/mol
Rotatable Bond Count:
1  
Topological Polar Surface Area:
33A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.1  
Properties