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1326283-14-0

1326283-14-0 | 1H-Pyrrolo[2,3-b]pyridine-2-carboxylic acid, 5-chloro-1-methyl-, methyl ester

CAS No: 1326283-14-0 Catalog No: AG0010WI MDL No:

Product Description

Catalog Number:
AG0010WI
Chemical Name:
1H-Pyrrolo[2,3-b]pyridine-2-carboxylic acid, 5-chloro-1-methyl-, methyl ester
CAS Number:
1326283-14-0
Molecular Formula:
C10H9ClN2O2
Molecular Weight:
224.6437
IUPAC Name:
methyl 5-chloro-1-methylpyrrolo[2,3-b]pyridine-2-carboxylate
InChI:
InChI=1S/C10H9ClN2O2/c1-13-8(10(14)15-2)4-6-3-7(11)5-12-9(6)13/h3-5H,1-2H3
InChI Key:
PQXOXXMIMYZQHW-UHFFFAOYSA-N
SMILES:
COC(=O)c1cc2c(n1C)ncc(c2)Cl

Properties

Complexity:
262  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
224.035g/mol
Formal Charge:
0
Heavy Atom Count:
15  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
224.644g/mol
Monoisotopic Mass:
224.035g/mol
Rotatable Bond Count:
2  
Topological Polar Surface Area:
44.1A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.1  

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