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Home > Bromides > 1263057-74-4
1263057-74-4 | (6-bromopyrazolo[1,5-a]pyrimidin-3-yl)methanol
CAS No: 1263057-74-4 Catalog No: AG01CCTS MDL No:
Product Description
Catalog Number:
AG01CCTS
Chemical Name:
(6-bromopyrazolo[1,5-a]pyrimidin-3-yl)methanol
CAS Number:
1263057-74-4
Molecular Formula:
C7H6BrN3O
Molecular Weight:
228.0460
IUPAC Name:
(6-bromopyrazolo[1,5-a]pyrimidin-3-yl)methanol
InChI:
InChI=1S/C7H6BrN3O/c8-6-2-9-7-5(4-12)1-10-11(7)3-6/h1-3,12H,4H2
InChI Key:
DSDFBKPVOFMRPO-UHFFFAOYSA-N
SMILES:
OCc1cnn2c1ncc(c2)Br
Properties
Complexity:
169
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
226.969g/mol
Formal Charge:
0
Heavy Atom Count:
12
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
228.049g/mol
Monoisotopic Mass:
226.969g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
50.4A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0.1
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