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Homatropine Bromide

CAT: 0607-B1603-1000Size: 1 gDry Ice: NoHazardous: No
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CAT#:0607-B1603-1000Size:1 g
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Description
Muscarinic AChR antagonist
CAS Number
51-56-9
Product Name Alternative
(8-methyl-8-azabicyclo[3.2.1]octan-3-yl) 2-hydroxy-2-phenylacetate;hydrobromide
Field of Research
Neuroscience AChR
Purity
0.9964
Form
A solid
Solubility
insoluble in EtOH; ≥17.81 mg/mL in DMSO; ≥47.4 mg/mL in H2O
Smiles
CN1C2CCC1CC(C2)OC(=O)C(C3=CC=CC=C3)O.Br
Molecular Formula
C16H21NO3·HBr
Molecular Weight
356.25
Shipping Conditions
Blue ice
Storage Conditions
Store at -20°C.

Chemical Information

Homatropine hydrobromide

See also: Homatropine Hydrobromide (annotation moved to); Homatropine (annotation moved to).

CAS Number51-56-9
PubChem CID6419941
IUPAC Name[(1S,5R)-8-methyl-8-azabicyclo[3.2.1]octan-3-yl] 2-hydroxy-2-phenylacetate;hydrobromide
Molecular FormulaC16H22BrNO3
Molecular Weight356.25
Topological Polar Surface Area49.8
Hydrogen Bond Donor Count2
Hydrogen Bond Acceptor Count4
Rotatable Bond Count4
Heavy Atom Count21
Formal Charge0
Complexity340
SMILES
CN1[C@@H]2CC[C@H]1CC(C2)OC(=O)C(C3=CC=CC=C3)O.Br
InChI
InChI=1S/C16H21NO3.BrH/c1-17-12-7-8-13(17)10-14(9-12)20-16(19)15(18)11-5-3-2-4-6-11;/h2-6,12-15,18H,7-10H2,1H3;1H/t12-,13+,14?,15?;
InChIKey
DWSGTFTVBLXELC-MOTQWOLNSA-N
Chemical Structure
2D Structure
2D structure of Homatropine hydrobromide
CAS: 51-56-9
CID: 6419941
Formula: C16H22BrNO3
MW: 356.25
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight356.25
Hydrogen Bond Donor Count2
Hydrogen Bond Acceptor Count4
Rotatable Bond Count4
Exact Mass355.07831
Monoisotopic Mass355.07831
Topological Polar Surface Area49.8 Ų
Heavy Atom Count21
Formal Charge0
Complexity340
Isotope Atom Count0
Defined Atom Stereocenter Count2
Undefined Atom Stereocenter Count1
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
Covalently-Bonded Unit Count2
Compound Is CanonicalizedYes

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Alternative Products

CatalogName
MBS3604792-01Homatropine Bromide
HY-B0547A-01Homatropine (Bromide)
H07260-01Homatropine methyl bromide
HY-B0547AR-01Homatropine (Bromide) (Standard)
AR-A04846-01Methyl Dehydro Homatropine Bromide
AR-H07618-01Homatropine Methylbromide EP Impurity A Bromide
RM-P180727-01Pregabalin EP Impurity C; Glycopyrronium Bromide EP Impurity C; Homatropine Hydrobromide EP Impurity C
HY-B0547Homatropine
T0427-01Homatropine Methylbromide
TRC-H669583-500MGHomatropine Hydrochloride

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