Home Other Building Blocks 3,4-dimethylpyridin-1-ium-1-olate

3,4-dimethylpyridin-1-ium-1-olate

CAS No.:
1796-86-7
Catalog Number:
AG01DNC4
Molecular Formula:
C7H9NO
Molecular Weight:
123.1525
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
1g
98%
In Stock USA
United States
$250
- +
5g
98%
In Stock USA
United States
$750
- +
Product Description
Catalog Number:
AG01DNC4
Chemical Name:
3,4-dimethylpyridin-1-ium-1-olate
CAS Number:
1796-86-7
Molecular Formula:
C7H9NO
Molecular Weight:
123.1525
MDL Number:
MFCD04971487
IUPAC Name:
3,4-dimethyl-1-oxidopyridin-1-ium
InChI:
InChI=1S/C7H9NO/c1-6-3-4-8(9)5-7(6)2/h3-5H,1-2H3
InChI Key:
LYFNWGOUBVRWRG-UHFFFAOYSA-N
SMILES:
[O-][n+]1ccc(c(c1)C)C
NSC Number:
187489
Properties
Complexity:
94.9  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
123.068g/mol
Formal Charge:
0
Heavy Atom Count:
9  
Hydrogen Bond Acceptor Count:
1  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
123.155g/mol
Monoisotopic Mass:
123.068g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
25.5A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0.6  
Properties