Home Carboxys 4-Chloropyridine-2-carboxylic acid tert-butyl ester

4-Chloropyridine-2-carboxylic acid tert-butyl ester

CAS No.:
220000-86-2
Catalog Number:
AG006XTU
Molecular Formula:
C10H12ClNO2
Molecular Weight:
213.6608
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
5g
95%
In Stock USA
United States
$324
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Product Description
Catalog Number:
AG006XTU
Chemical Name:
4-Chloropyridine-2-carboxylic acid tert-butyl ester
CAS Number:
220000-86-2
Molecular Formula:
C10H12ClNO2
Molecular Weight:
213.6608
MDL Number:
MFCD10565714
IUPAC Name:
tert-butyl 4-chloropyridine-2-carboxylate
InChI:
InChI=1S/C10H12ClNO2/c1-10(2,3)14-9(13)8-6-7(11)4-5-12-8/h4-6H,1-3H3
InChI Key:
BSCMJQUASNXFIA-UHFFFAOYSA-N
SMILES:
O=C(c1nccc(c1)Cl)OC(C)(C)C
Properties
Complexity:
213  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
213.056g/mol
Formal Charge:
0
Heavy Atom Count:
14  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
213.661g/mol
Monoisotopic Mass:
213.056g/mol
Rotatable Bond Count:
3  
Topological Polar Surface Area:
39.2A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.7  
Properties