Adrenaline Bitartrate 98% AR

CAT: 1507-7800001Size: 1 mgDry Ice: NoHazardous: No

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CAS Number

51-42-3

HSN Code

29379090

Chemical Information

Epinephrine Bitartrate

Epinephrine Bitartrate is the bitartrate salt form of epinephrine, a direct-acting sympathomimetic amine with bronchodilator and vasoconstricting activity.

CAS Number	51-42-3
PubChem CID	5815
IUPAC Name	(2R,3R)-2,3-dihydroxybutanedioic acid;4-[(1R)-1-hydroxy-2-(methylamino)ethyl]benzene-1,2-diol
Molecular Formula	C13H19NO9
Molecular Weight	333.29
Topological Polar Surface Area	188
Hydrogen Bond Donor Count	8
Hydrogen Bond Acceptor Count	10
Rotatable Bond Count	6
Heavy Atom Count	23
Formal Charge	0
Complexity	288

SMILES

CNC[C@@H](C1=CC(=C(C=C1)O)O)O.[C@@H]([C@H](C(=O)O)O)(C(=O)O)O

InChI

InChI=1S/C9H13NO3.C4H6O6/c1-10-5-9(13)6-2-3-7(11)8(12)4-6;5-1(3(7)8)2(6)4(9)10/h2-4,9-13H,5H2,1H3;1-2,5-6H,(H,7,8)(H,9,10)/t9-;1-,2-/m01/s1

InChIKey

YLXIPWWIOISBDD-NDAAPVSOSA-N

Chemical Structure

2D Structure

CAS: 51-42-3

CID: 5815

Formula: C13H19NO9

MW: 333.29

Interactive 3D Structure

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View on PubChem Raw 3D data

Computed Properties

Property	Value
Molecular Weight	333.29
Hydrogen Bond Donor Count	8
Hydrogen Bond Acceptor Count	10
Rotatable Bond Count	6
Exact Mass	333.10598118
Monoisotopic Mass	333.10598118
Topological Polar Surface Area	188 Å²
Heavy Atom Count	23
Formal Charge	0
Complexity	288
Isotope Atom Count	0
Defined Atom Stereocenter Count	3
Undefined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Undefined Bond Stereocenter Count	0
Covalently-Bonded Unit Count	2
Compound Is Canonicalized	Yes

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Adrenaline Bitartrate 98% AR

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