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rac-trans-7-Hydroxy Pramipexole

CAT: 0572-TRC-H952145-10MGSize: 10 mgDry Ice: NoHazardous: No
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CAT#:0572-TRC-H952145-10MGSize:10 mg
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24/48H Stock Items & 2 to 6 Weeks non Stock Items.
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CAS Number
1246818-51-8
Synonyms
7-Benzothiazolol, 2-amino-4,5,6,7-tetrahydro-6-(propylamino)-, (6R,7S)-rel-; rel-(6R,7S)-2-Amino-4,5,6,7-tetrahydro-6-(propylamino)-7-benzothiazolol; (6SR,7RS)-2-Amino-6-(propylamino)-4,5,6,7-tetrahydrobenzothiazol-7-ol; rac-trans-7-Hydroxypramipexole; (±)-trans-7-Hydroxypramipexole
Hazard Statement
Not a hazardous substance according to GHS.
Purity
>95% (HPLC)
Smiles
CCCN[C@H]1CCc2nc(N)sc2[C@@H]1O
Molecular Formula
C10 H17 N3 O S
Molecular Weight
227.33
InChI
InChI=1S/C10H17N3OS/c1-2-5-12-6-3-4-7-9(8(6)14)15-10(11)13-7/h6,8,12,14H,2-5H2,1H3,(H2,11,13)/t6-,8+/m0/s1
Additionnal Information
IUPAC name: (6S,7R)-2-amino-6-(propylamino)-4,5,6,7-tetrahydro-1,3-benzothiazol-7-ol
Shipping Conditions
Room Temperature
Storage Conditions
-20°C

Chemical Information

rac-trans-7-Hydroxy Pramipexole
CAS Number1246818-51-8
PubChem CID71749272
IUPAC Name(6S,7R)-2-amino-6-(propylamino)-4,5,6,7-tetrahydro-1,3-benzothiazol-7-ol
Molecular FormulaC10H17N3OS
Molecular Weight227.33
XLogP0.7
Topological Polar Surface Area99.4
Hydrogen Bond Donor Count3
Hydrogen Bond Acceptor Count5
Rotatable Bond Count3
Heavy Atom Count15
Formal Charge0
Complexity217
SMILES
CCCN[C@H]1CCC2=C([C@@H]1O)SC(=N2)N
InChI
InChI=1S/C10H17N3OS/c1-2-5-12-6-3-4-7-9(8(6)14)15-10(11)13-7/h6,8,12,14H,2-5H2,1H3,(H2,11,13)/t6-,8+/m0/s1
InChIKey
UWNDKVURLHPSSG-POYBYMJQSA-N
Chemical Structure
2D Structure
2D structure of rac-trans-7-Hydroxy Pramipexole
CAS: 1246818-51-8
CID: 71749272
Formula: C10H17N3OS
MW: 227.33
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight227.33
XLogP30.7
Hydrogen Bond Donor Count3
Hydrogen Bond Acceptor Count5
Rotatable Bond Count3
Exact Mass227.10923335
Monoisotopic Mass227.10923335
Topological Polar Surface Area99.4 Ų
Heavy Atom Count15
Formal Charge0
Complexity217
Isotope Atom Count0
Defined Atom Stereocenter Count2
Undefined Atom Stereocenter Count0
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
Covalently-Bonded Unit Count1
Compound Is CanonicalizedYes

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Alternative Products

CatalogName
014340Rac-trans-7-Hydroxy Pramipexole
AR-P02447-01Rac-trans-7-Hydroxy-Pramipexole
014339-01Rac-cis-7-Hydroxy Pramipexole
RM-P181633-01Rac-Cis-7-Hydroxy-Pramipexole
288815-01Rac-cis-7-hydroxy pramipexole discontinued. See 014339
sc-477850Rac-7-Oxo-pramipexole Dihydrochloride
VPD70868-01Rac-7-Oxo-pramipexole hydrochloride
AR-P32294-01Rac-7-Oxo-Pramipexole DiHCl
AR-P02445-01Rac-7-Oxo-Pramipexole HCl
166253Rac-6,7-Dehydro-pramipexole

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