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Home Other Building Blocks 2-(4-BOC-Aminophenyl)nicotinic acid

2-(4-BOC-Aminophenyl)nicotinic acid

CAS No.:
1261951-56-7
Catalog Number:
AG000S8Z
Molecular Formula:
C17H18N2O4
Molecular Weight:
314.3358
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
250mg
98%
In Stock USA
United States
$275
- +
1g
98%
In Stock USA
United States
$688
- +
Product Description
Catalog Number:
AG000S8Z
Chemical Name:
2-(4-BOC-Aminophenyl)nicotinic acid
CAS Number:
1261951-56-7
Molecular Formula:
C17H18N2O4
Molecular Weight:
314.3358
MDL Number:
MFCD18318702
IUPAC Name:
2-[4-[(2-methylpropan-2-yl)oxycarbonylamino]phenyl]pyridine-3-carboxylic acid
InChI:
InChI=1S/C17H18N2O4/c1-17(2,3)23-16(22)19-12-8-6-11(7-9-12)14-13(15(20)21)5-4-10-18-14/h4-10H,1-3H3,(H,19,22)(H,20,21)
InChI Key:
IQIATTSOJFUXNS-UHFFFAOYSA-N
SMILES:
O=C(OC(C)(C)C)Nc1ccc(cc1)c1ncccc1C(=O)O
Properties
Complexity:
425  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
314.127g/mol
Formal Charge:
0
Heavy Atom Count:
23  
Hydrogen Bond Acceptor Count:
5  
Hydrogen Bond Donor Count:
2  
Isotope Atom Count:
0
Molecular Weight:
314.341g/mol
Monoisotopic Mass:
314.127g/mol
Rotatable Bond Count:
5  
Topological Polar Surface Area:
88.5A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.6  
Properties