Home Carbonyls 4-(Methoxycarbonyl)nicotinic acid

4-(Methoxycarbonyl)nicotinic acid

CAS No.:
24202-74-2
Catalog Number:
AG00BCT1
Molecular Formula:
C8H7NO4
Molecular Weight:
181.1455
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
250mg
90%
In Stock USA
United States
$183
- +
1g
90%
In Stock USA
United States
$351
- +
Product Description
Catalog Number:
AG00BCT1
Chemical Name:
4-(Methoxycarbonyl)nicotinic acid
CAS Number:
24202-74-2
Molecular Formula:
C8H7NO4
Molecular Weight:
181.1455
MDL Number:
MFCD00111513
IUPAC Name:
4-methoxycarbonylpyridine-3-carboxylic acid
InChI:
InChI=1S/C8H7NO4/c1-13-8(12)5-2-3-9-4-6(5)7(10)11/h2-4H,1H3,(H,10,11)
InChI Key:
QLOYEIURVSRKOV-UHFFFAOYSA-N
SMILES:
COC(=O)c1ccncc1C(=O)O
NSC Number:
302958
Properties
Complexity:
216  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
181.038g/mol
Formal Charge:
0
Heavy Atom Count:
13  
Hydrogen Bond Acceptor Count:
5  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
181.147g/mol
Monoisotopic Mass:
181.038g/mol
Rotatable Bond Count:
3  
Topological Polar Surface Area:
76.5A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0.2  
Properties