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Home > Boronic Acids > 1229041-97-7
1229041-97-7 | (7H-pyrrolo[2,3-d]pyriMidin-4-yl)boronic acid
CAS No: 1229041-97-7 Catalog No: AG009YYA MDL No:
Product Description
Catalog Number:
AG009YYA
Chemical Name:
(7H-pyrrolo[2,3-d]pyriMidin-4-yl)boronic acid
CAS Number:
1229041-97-7
IUPAC Name:
7H-pyrrolo[2,3-d]pyrimidin-4-ylboronic acid
InChI:
InChI=1S/C6H6BN3O2/c11-7(12)5-4-1-2-8-6(4)10-3-9-5/h1-3,11-12H,(H,8,9,10)
InChI Key:
VOSXZXFJSJGKBZ-UHFFFAOYSA-N
Properties
Complexity:
169
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
163.055g/mol
Formal Charge:
0
Heavy Atom Count:
12
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
3
Isotope Atom Count:
0
Molecular Weight:
162.943g/mol
Monoisotopic Mass:
163.055g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
82A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
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