Home Nitriles 2-Formyl-6-methylbenzonitrile

2-Formyl-6-methylbenzonitrile

CAS No.:
27613-37-2
Catalog Number:
AG002U96
Molecular Formula:
C9H7NO
Molecular Weight:
145.1580
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
1g
98%
In Stock USA
United States
$325
- +
5g
98%
In Stock USA
United States
$963
- +
25g
98%
In Stock USA
United States
$2900
- +
Product Description
Catalog Number:
AG002U96
Chemical Name:
2-Formyl-6-methylbenzonitrile
CAS Number:
27613-37-2
Molecular Formula:
C9H7NO
Molecular Weight:
145.1580
MDL Number:
MFCD16659619
IUPAC Name:
2-formyl-6-methylbenzonitrile
InChI:
InChI=1S/C9H7NO/c1-7-3-2-4-8(6-11)9(7)5-10/h2-4,6H,1H3
InChI Key:
INEMMACKKKQZAM-UHFFFAOYSA-N
SMILES:
O=Cc1cccc(c1C#N)C
Properties
Complexity:
191  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
145.053g/mol
Formal Charge:
0
Heavy Atom Count:
11  
Hydrogen Bond Acceptor Count:
2  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
145.161g/mol
Monoisotopic Mass:
145.053g/mol
Rotatable Bond Count:
1  
Topological Polar Surface Area:
40.9A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.5  
Properties