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876379-77-0 | 3-Bromopyrazolo[1,5-a]pyridine-2-carboxylic acid
CAS No: 876379-77-0 Catalog No: AG004HV7 MDL No:MFCD10566761
Product Description
Catalog Number:
AG004HV7
Chemical Name:
3-Bromopyrazolo[1,5-a]pyridine-2-carboxylic acid
CAS Number:
876379-77-0
Molecular Formula:
C8H5BrN2O2
Molecular Weight:
241.0415
MDL Number:
MFCD10566761
IUPAC Name:
3-bromopyrazolo[1,5-a]pyridine-2-carboxylic acid
InChI:
InChI=1S/C8H5BrN2O2/c9-6-5-3-1-2-4-11(5)10-7(6)8(12)13/h1-4H,(H,12,13)
InChI Key:
NGRRVZUNAISFSH-UHFFFAOYSA-N
SMILES:
OC(=O)c1nn2c(c1Br)cccc2
Properties
Complexity:
224
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
239.953g/mol
Formal Charge:
0
Heavy Atom Count:
13
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
241.044g/mol
Monoisotopic Mass:
239.953g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
54.6A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.6
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