Home Other Building Blocks 6-(tert-Butyl)-4-hydroxynicotinic acid

6-(tert-Butyl)-4-hydroxynicotinic acid

CAS No.:
1367828-93-0
Catalog Number:
AG0012CJ
Molecular Formula:
C10H13NO3
Molecular Weight:
195.2151
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
250mg
95%
1 week
United States
$732
- +
1g
95%
1 week
United States
$1413
- +
Product Description
Catalog Number:
AG0012CJ
Chemical Name:
6-(tert-Butyl)-4-hydroxynicotinic acid
CAS Number:
1367828-93-0
Molecular Formula:
C10H13NO3
Molecular Weight:
195.2151
MDL Number:
MFCD22060424
IUPAC Name:
6-tert-butyl-4-oxo-1H-pyridine-3-carboxylic acid
InChI:
InChI=1S/C10H13NO3/c1-10(2,3)8-4-7(12)6(5-11-8)9(13)14/h4-5H,1-3H3,(H,11,12)(H,13,14)
InChI Key:
QWXVBXWTSVKMDP-UHFFFAOYSA-N
SMILES:
OC(=O)c1cnc(cc1O)C(C)(C)C
Properties
Complexity:
345  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
195.09g/mol
Formal Charge:
0
Heavy Atom Count:
14  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
2  
Isotope Atom Count:
0
Molecular Weight:
195.218g/mol
Monoisotopic Mass:
195.09g/mol
Rotatable Bond Count:
2  
Topological Polar Surface Area:
66.4A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.1  
Properties