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Home > Bromides > 1159981-95-9
1159981-95-9 | Pyrazolo[1,5-a]pyrimidine, 5-bromo-
CAS No: 1159981-95-9 Catalog No: AG000HEG MDL No:MFCD11042744
Product Description
Catalog Number:
AG000HEG
Chemical Name:
Pyrazolo[1,5-a]pyrimidine, 5-bromo-
CAS Number:
1159981-95-9
Molecular Formula:
C6H4BrN3
Molecular Weight:
198.0201
MDL Number:
MFCD11042744
IUPAC Name:
5-bromopyrazolo[1,5-a]pyrimidine
InChI:
InChI=1S/C6H4BrN3/c7-5-2-4-10-6(9-5)1-3-8-10/h1-4H
InChI Key:
DIYTVASYDOBYQA-UHFFFAOYSA-N
SMILES:
Brc1ccn2c(n1)ccn2
Properties
Complexity:
130
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
196.959g/mol
Formal Charge:
0
Heavy Atom Count:
10
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
198.023g/mol
Monoisotopic Mass:
196.959g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
30.2A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.4
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