Home Nitriles 3-Methoxy-4-methylbenzonitrile

3-Methoxy-4-methylbenzonitrile

CAS No.:
3556-60-3
Catalog Number:
AG003JMW
Molecular Formula:
C9H9NO
Molecular Weight:
147.1739
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
1g
98%
In Stock USA
United States
$25
- +
5g
98%
In Stock USA
United States
$62
- +
10g
98%
In Stock USA
United States
$114
- +
25g
98%
In Stock USA
United States
$188
- +
100g
98%
In Stock USA
United States
$438
- +
Product Description
Catalog Number:
AG003JMW
Chemical Name:
3-Methoxy-4-methylbenzonitrile
CAS Number:
3556-60-3
Molecular Formula:
C9H9NO
Molecular Weight:
147.1739
MDL Number:
MFCD03428590
IUPAC Name:
3-methoxy-4-methylbenzonitrile
InChI:
InChI=1S/C9H9NO/c1-7-3-4-8(6-10)5-9(7)11-2/h3-5H,1-2H3
InChI Key:
QLJZMAGXHHXXMS-UHFFFAOYSA-N
SMILES:
COc1cc(C#N)ccc1C
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:
2.5  
Properties