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Home Other Building Blocks 2-(4-Ethylpiperazino)isonicotinic acid

2-(4-Ethylpiperazino)isonicotinic acid

CAS No.:
1019323-95-5
Catalog Number:
AG00H9OF
Molecular Formula:
C12H17N3O2
Molecular Weight:
235.2823
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
1g
98%
In Stock USA
United States
$75
- +
5g
98%
In Stock USA
United States
$275
- +
25g
98%
In Stock USA
United States
$1000
- +
Product Description
Catalog Number:
AG00H9OF
Chemical Name:
2-(4-Ethylpiperazino)isonicotinic acid
CAS Number:
1019323-95-5
Molecular Formula:
C12H17N3O2
Molecular Weight:
235.2823
MDL Number:
MFCD11132193
IUPAC Name:
2-(4-ethylpiperazin-1-yl)pyridine-4-carboxylic acid
InChI:
InChI=1S/C12H17N3O2/c1-2-14-5-7-15(8-6-14)11-9-10(12(16)17)3-4-13-11/h3-4,9H,2,5-8H2,1H3,(H,16,17)
InChI Key:
FAKNXFPZRGXHJR-UHFFFAOYSA-N
SMILES:
CCN1CCN(CC1)c1nccc(c1)C(=O)O
Properties
Complexity:
265  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
235.132g/mol
Formal Charge:
0
Heavy Atom Count:
17  
Hydrogen Bond Acceptor Count:
5  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
235.287g/mol
Monoisotopic Mass:
235.132g/mol
Rotatable Bond Count:
3  
Topological Polar Surface Area:
56.7A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
-1.3  
Properties