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Pilocarpine Hydrochloride

CAT: 0203-28008-31Size: 1 gDry Ice: NoHazardous: Yes
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CAT#:0203-28008-31Size:1 g
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CAS Number
54-71-7
UN Code
1544
Purity
≧ 98.0% (T)
Storage Conditions
Room Temperature
Grade
GR (Guaranteed Reagent)

Chemical Information

Pilocarpine Hydrochloride

Pilocarpine hydrochloride is the hydrochloride salt of (+)-pilocarpine, a medication used to treat increased pressure inside the eye and dry mouth. It contains a (+)-pilocarpine.

CAS Number54-71-7
PubChem CID5909
IUPAC Name(3S,4R)-3-ethyl-4-[(3-methylimidazol-4-yl)methyl]oxolan-2-one;hydrochloride
Molecular FormulaC11H17ClN2O2
Molecular Weight244.72
Topological Polar Surface Area44.1
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count3
Rotatable Bond Count3
Heavy Atom Count16
Formal Charge0
Complexity245
SMILES
CC[C@H]1[C@H](COC1=O)CC2=CN=CN2C.Cl
InChI
InChI=1S/C11H16N2O2.ClH/c1-3-10-8(6-15-11(10)14)4-9-5-12-7-13(9)2;/h5,7-8,10H,3-4,6H2,1-2H3;1H/t8-,10-;/m0./s1
InChIKey
RNAICSBVACLLGM-GNAZCLTHSA-N
Chemical Structure
2D Structure
2D structure of Pilocarpine Hydrochloride
CAS: 54-71-7
CID: 5909
Formula: C11H17ClN2O2
MW: 244.72
Interactive 3D Structure
Loading 3D structure...
Computed Properties
PropertyValue
Molecular Weight244.72
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count3
Rotatable Bond Count3
Exact Mass244.0978555
Monoisotopic Mass244.0978555
Topological Polar Surface Area44.1 Ų
Heavy Atom Count16
Formal Charge0
Complexity245
Isotope Atom Count0
Defined Atom Stereocenter Count2
Undefined Atom Stereocenter Count0
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
Covalently-Bonded Unit Count2
Compound Is CanonicalizedYes