Exo-2,3-Norbornanedicarboximide

CAT: 1596-AR-I07843-01Size: 50 UnitsDry Ice: NoHazardous: No

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CAT#:1596-AR-I07843-01Size:50 Units

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CAS Number

14805-29-9

Synonyms

(3aR,4S,7R,7aS) -rel-Hexahydro-4,7-methano-1H-isoindole-1,3 (2H) -dione; Lurasidone USP Related Compound A

Molecular Formula

C9H11NO2

Molecular Weight

165.19

API Name

Lurasidone

Chemical Information

(3aR,4S,7R,7aS)-Hexahydro-1H-4,7-methanoisoindole-1,3(2H)-dione

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CAS Number	14805-29-9
PubChem CID	10749555
IUPAC Name	(1R,2S,6R,7S)-4-azatricyclo[5.2.1.02,6]decane-3,5-dione
Molecular Formula	C9H11NO2
Molecular Weight	165.19
XLogP	0.7
Topological Polar Surface Area	46.2
Hydrogen Bond Donor Count	1
Hydrogen Bond Acceptor Count	2
Rotatable Bond Count	0
Heavy Atom Count	12
Formal Charge	0
Complexity	248

SMILES

C1C[C@H]2C[C@@H]1[C@H]3[C@@H]2C(=O)NC3=O

InChI

InChI=1S/C9H11NO2/c11-8-6-4-1-2-5(3-4)7(6)9(12)10-8/h4-7H,1-3H2,(H,10,11,12)/t4-,5+,6+,7-

InChIKey

RIVOBMOBWMOLDJ-RNGGSSJXSA-N

Chemical Structure

2D Structure

CAS: 14805-29-9

CID: 10749555

Formula: C9H11NO2

MW: 165.19

Interactive 3D Structure

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Computed Properties

Property	Value
Molecular Weight	165.19
XLogP3	0.7
Hydrogen Bond Donor Count	1
Hydrogen Bond Acceptor Count	2
Rotatable Bond Count	0
Exact Mass	165.078978594
Monoisotopic Mass	165.078978594
Topological Polar Surface Area	46.2 Å²
Heavy Atom Count	12
Formal Charge	0
Complexity	248
Isotope Atom Count	0
Defined Atom Stereocenter Count	4
Undefined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Undefined Bond Stereocenter Count	0
Covalently-Bonded Unit Count	1
Compound Is Canonicalized	Yes

Catalog	Name
AR-L07994-01	Exo-Norbornane-2,3-dicarboxylic Anhydride
AR-L02136-01	Cis-exo-5-Norbornene-2,3-Dicarboximide
AR-C08636-01	Exo-Tetrahydrodicyclopentadiene
AR-I03542-01	Indisetron exo-Isomer
AR-I01487-01	Indisetron exo-Isomer
AR-A06221-01	Exo-Mecamylamine HCl
AR-M03882-01	Exo-Maraviroc R-isomer
AR-A06220-01	N-Nitroso exo-Mecamylamine
AR-L00993-01	S, S-exo-Lurasidone Hydrochloride
AR-L06340-01	Exo-cis-Lurasidone (R, S) Impurity

Catalog	Name
sc-478753B	Exo-2,3-Norbornanedicarboximide
sc-478752	Endo-2,3-Norbornanedicarboximide
sc-235120	(±) -exo, exo-2,3-Camphanediol
sc-487204	5-Norbornene-2-exo,3-exo-dimethanol
3146-39-2	EXO-2,3-EPOXYNORBORNANE
449873-01	Exo-2, 3-Epoxynorbornane
sc-326370A	Boc-3-exo-aminobicyclo[2.2.1]-heptane-2-exo-carboxylic acid
278195-01	Fmoc-3-exo-aminobicyclo[2.2.1]-heptane-2-exo-carboxylic acid
sc-235114	Exo-2-Chloronorbornane
sc-228107	Exo-2-Norbornylisothiocyanate