Palbociclib Impurity B

CAT: 1299-RM-P020302-02Size: 25 mgDry Ice: NoHazardous: No

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CAT#:1299-RM-P020302-02Size:25 mg

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24/48H Stock Items & 2 to 6 Weeks non Stock Items.

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CAS Number

1072-97-5

Synonyms

5-bromopyridin-2-amine

Molecular Formula

C5H5BrN2

Molecular Weight

173.01

Target Alternative Name

Palbociclib

Product Name Synonym

5-bromopyridin-2-amine

Chemical Information

2-Amino-5-bromopyridine

CAS Number	1072-97-5
PubChem CID	70622
IUPAC Name	5-bromopyridin-2-amine
Molecular Formula	C5H5BrN2
Molecular Weight	173.01
XLogP	1.2
Topological Polar Surface Area	38.9
Hydrogen Bond Donor Count	1
Hydrogen Bond Acceptor Count	2
Rotatable Bond Count	0
Heavy Atom Count	8
Formal Charge	0
Complexity	76

SMILES

C1=CC(=NC=C1Br)N

InChI

InChI=1S/C5H5BrN2/c6-4-1-2-5(7)8-3-4/h1-3H,(H2,7,8)

InChIKey

WGOLHUGPTDEKCF-UHFFFAOYSA-N

Chemical Structure

2D Structure

CAS: 1072-97-5

CID: 70622

Formula: C5H5BrN2

MW: 173.01

Interactive 3D Structure

Loading 3D structure...

Computed Properties

Property	Value
Molecular Weight	173.01
XLogP3	1.2
Hydrogen Bond Donor Count	1
Hydrogen Bond Acceptor Count	2
Rotatable Bond Count	0
Exact Mass	171.96361
Monoisotopic Mass	171.96361
Topological Polar Surface Area	38.9 Å²
Heavy Atom Count	8
Formal Charge	0
Complexity	76.8
Isotope Atom Count	0
Defined Atom Stereocenter Count	0
Undefined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Undefined Bond Stereocenter Count	0
Covalently-Bonded Unit Count	1
Compound Is Canonicalized	Yes