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Metaraminol Bitartrate

CAT: 0572-TRC-M225565-100MGSize: 100 mgDry Ice: NoHazardous: No
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CAT#:0572-TRC-M225565-100MGSize:100 mg
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24/48H Stock Items & 2 to 6 Weeks non Stock Items.
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CAS Number
33402-03-8
Synonyms
(-)-Metaraminol bitartrate; Aramine; Aramine (sympathomimetic); Icoral B; Metaradrine bitartrate; Metaraminol bitartrate; Metaraminol hydrogen tartrate; Metaraminol tartrate; Pressorol; Benzenemethanol, alpha-[(1S)-1-aminoethyl]-3-hydroxy-, (alphaR)-, (2R,3R)-2,3-dihydroxybutanedioate (1:1); Benzenemethanol, alpha-(1-aminoethyl)-3-hydroxy-, [R-(R*,S*)]-, [R-(R*,R*)]-2,3-dihydroxybutanedioate (1:1) (salt); Benzenemethanol, alpha-[(1S)-1-aminoethyl]-3-hydroxy-, (alphaR)-, (2R,3R)-2,3-dihydroxybutanedioate (1:1) (salt) (9CI); Benzyl alcohol, alpha-(1-aminoethyl)-m-hydroxy-, (-)-, tartrate (1:1) (salt) (8CI)
Hazard Statement
Toxic if swallowed; UN number: UN2811; Packing Group: III
Purity
>95% (HPLC)
Smiles
C[C@H](N)[C@H](O)c1cccc(O)c1.O[C@H]([C@@H](O)C(=O)O)C(=O)O
Molecular Formula
C9 H13 N O2 . C4 H6 O6
Molecular Weight
317.29
InChI
InChI=1S/C9H13NO2.C4H6O6/c1-6(10)9(12)7-3-2-4-8(11)5-7;5-1(3(7)8)2(6)4(9)10/h2-6,9,11-12H,10H2,1H3;1-2,5-6H,(H,7,8)(H,9,10)/t6-,9-;1-,2-/m01/s1
Additionnal Information
IUPAC name: 3-[(1R,2S)-2-amino-1-hydroxypropyl]phenol;(2R,3R)-2,3-dihydroxybutanedioic acid
Shipping Conditions
Room Temperature
Storage Conditions
+4°C

Chemical Information

Metaraminol Bitartrate

See also: Metaraminol (has active moiety).

CAS Number33402-03-8
PubChem CID441414
IUPAC Name3-[(1R,2S)-2-amino-1-hydroxypropyl]phenol;(2R,3R)-2,3-dihydroxybutanedioic acid
Molecular FormulaC13H19NO8
Molecular Weight317.29
Topological Polar Surface Area182
Hydrogen Bond Donor Count7
Hydrogen Bond Acceptor Count9
Rotatable Bond Count5
Heavy Atom Count22
Formal Charge0
Complexity274
SMILES
C[C@@H]([C@@H](C1=CC(=CC=C1)O)O)N.[C@@H]([C@H](C(=O)O)O)(C(=O)O)O
InChI
InChI=1S/C9H13NO2.C4H6O6/c1-6(10)9(12)7-3-2-4-8(11)5-7;5-1(3(7)8)2(6)4(9)10/h2-6,9,11-12H,10H2,1H3;1-2,5-6H,(H,7,8)(H,9,10)/t6-,9-;1-,2-/m01/s1
InChIKey
VENXSELNXQXCNT-IJYXXVHRSA-N
Chemical Structure
2D Structure
2D structure of Metaraminol Bitartrate
CAS: 33402-03-8
CID: 441414
Formula: C13H19NO8
MW: 317.29
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight317.29
Hydrogen Bond Donor Count7
Hydrogen Bond Acceptor Count9
Rotatable Bond Count5
Exact Mass317.11106656
Monoisotopic Mass317.11106656
Topological Polar Surface Area182 Ų
Heavy Atom Count22
Formal Charge0
Complexity274
Isotope Atom Count0
Defined Atom Stereocenter Count4
Undefined Atom Stereocenter Count0
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
Covalently-Bonded Unit Count2
Compound Is CanonicalizedYes

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