Risdiplam Impurity 16 DiHCl

CAT: 1596-AR-R11018-01Size: 10 UnitsDry Ice: NoHazardous: No

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CAT#:1596-AR-R11018-01Size:10 Units

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CAS Number

145122-56-1

Molecular Formula

C6H12N2. 2 HCl

Molecular Weight

112.18 2*36.46

API Name

Risdiplam

Chemical Information

4,7-Diazaspiro(2.5)octane dihydrochloride

CAS Number	145122-56-1
PubChem CID	56973368
IUPAC Name	4,7-diazaspiro[2.5]octane;dihydrochloride
Molecular Formula	C6H14Cl2N2
Molecular Weight	185.09
Topological Polar Surface Area	24.1
Hydrogen Bond Donor Count	4
Hydrogen Bond Acceptor Count	2
Rotatable Bond Count	0
Heavy Atom Count	10
Formal Charge	0
Complexity	96

SMILES

C1CC12CNCCN2.Cl.Cl

InChI

InChI=1S/C6H12N2.2ClH/c1-2-6(1)5-7-3-4-8-6;;/h7-8H,1-5H2;2*1H

InChIKey

MWCKCAQLDIGIMK-UHFFFAOYSA-N

Chemical Structure

2D Structure

CAS: 145122-56-1

CID: 56973368

Formula: C6H14Cl2N2

MW: 185.09

Interactive 3D Structure

Loading 3D structure...

Computed Properties

Property	Value
Molecular Weight	185.09
Hydrogen Bond Donor Count	4
Hydrogen Bond Acceptor Count	2
Rotatable Bond Count	0
Exact Mass	184.0534038
Monoisotopic Mass	184.0534038
Topological Polar Surface Area	24.1 Å²
Heavy Atom Count	10
Formal Charge	0
Complexity	96.7
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	3
Compound Is Canonicalized	Yes

Catalog	Name
AR-L07026-01	Levocetirizine Impurity 16 DiHCl
AR-C02348-01	Cetirizine Impurity 16 DiHCl
AR-C06134-01	Carbocisteine Impurity 16 DiHCl
AR-C07042-01	Cetirizine Impurity 16 DiHCl (Mixture of Cetirizine Impurity 12 DiHCl and Cetirizine Impurity 14 DiHCl)
AR-R11019-01	Risdiplam Impurity 17
AR-R11020-01	Risdiplam Impurity 18
AR-R11021-01	Risdiplam Impurity 19
AR-R11010-01	Risdiplam Impurity 6
AR-R11016-01	Risdiplam Impurity 14
AR-R11011-01	Risdiplam Impurity 7