Home Nitriles 4-Hydroxy-2,3-dimethylbenzonitrile

4-Hydroxy-2,3-dimethylbenzonitrile

CAS No.:
448961-58-8
Catalog Number:
AG00DKZ2
Molecular Formula:
C9H9NO
Molecular Weight:
147.1739
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
100mg
95%
In Stock USA
United States
$102
- +
250mg
95%
In Stock USA
United States
$185
- +
1g
95%
In Stock USA
United States
$370
- +
5g
95%
In Stock USA
United States
$1109
- +
Product Description
Catalog Number:
AG00DKZ2
Chemical Name:
4-Hydroxy-2,3-dimethylbenzonitrile
CAS Number:
448961-58-8
Molecular Formula:
C9H9NO
Molecular Weight:
147.1739
MDL Number:
MFCD13659357
IUPAC Name:
4-hydroxy-2,3-dimethylbenzonitrile
InChI:
InChI=1S/C9H9NO/c1-6-7(2)9(11)4-3-8(6)5-10/h3-4,11H,1-2H3
InChI Key:
LUOBVTFFWKJVTN-UHFFFAOYSA-N
SMILES:
N#Cc1ccc(c(c1C)C)O
Properties
Complexity:
181  
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:
1  
Isotope Atom Count:
0
Molecular Weight:
147.177g/mol
Monoisotopic Mass:
147.068g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
44A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.3  
Properties