Apixaban Impurity 148

CAT: 1596-AR-A06789-04Size: 100 UnitsDry Ice: NoHazardous: No

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CAT#:1596-AR-A06789-04Size:100 Units

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

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CAS Number

2455-05-2

Molecular Formula

C5H10ClNO

Molecular Weight

135.59

API Name

Apixaban

Chemical Information

5-Chloropentanamide

CAS Number	2455-05-2
PubChem CID	19047178
IUPAC Name	5-chloropentanamide
Molecular Formula	C5H10ClNO
Molecular Weight	135.59
XLogP	0.4
Topological Polar Surface Area	43.1
Hydrogen Bond Donor Count	1
Hydrogen Bond Acceptor Count	1
Rotatable Bond Count	4
Heavy Atom Count	8
Formal Charge	0
Complexity	74

SMILES

C(CCCl)CC(=O)N

InChI

InChI=1S/C5H10ClNO/c6-4-2-1-3-5(7)8/h1-4H2,(H2,7,8)

InChIKey

DCPLYSRLHGHNMY-UHFFFAOYSA-N

Chemical Structure

2D Structure

CAS: 2455-05-2

CID: 19047178

Formula: C5H10ClNO

MW: 135.59

Interactive 3D Structure

Loading 3D structure...

Computed Properties

Property	Value
Molecular Weight	135.59
XLogP3	0.4
Hydrogen Bond Donor Count	1
Hydrogen Bond Acceptor Count	1
Rotatable Bond Count	4
Exact Mass	135.0450916
Monoisotopic Mass	135.0450916
Topological Polar Surface Area	43.1 Å²
Heavy Atom Count	8
Formal Charge	0
Complexity	74.8
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