Homatropine hydrobromide
Properties
- Molecular formula
- C16H22BrNO3
- Molar mass
- 356.26 g/mol
- Exact mass
- 355.0783 Da
- Melting point
- 250 °C (decomposes)
- logP
- 2.47Crippen estimate
- Polar surface area
- 49.8 Ų
- H-bond donors / acceptors
- 1 / 4
- Rotatable bonds
- 3
- Stereocentres
- R, S, rin SMILES atom order
Identifiers
CAS number
51-56-9SMILES
Br.CN1[C@@H]2CC[C@H]1C[C@@H](OC(=O)C(O)c1ccccc1)C2InChIKey
DWSGTFTVBLXELC-RDYJJYPNNA-NInChI
InChI=1/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?;Weigh it out
Type any one amount. The others follow from the molar mass.
Names and synonyms
8 names
- Benzeneacetic acid, α-hydroxy-, (3-endo)-8-methyl-8-azabicyclo[3.2.1]oct-3-yl ester, hydrobromide (1:1)
- 1αH,5αH-Tropan-3α-ol, mandelate (ester), hydrobromide
- Benzeneacetic acid, α-hydroxy-, 8-methyl-8-azabicyclo[3.2.1]oct-3-yl ester, hydrobromide, endo-
- Benzeneacetic acid, α-hydroxy-, (3-endo)-8-methyl-8-azabicyclo[3.2.1]oct-3-yl ester, hydrobromide
- Mandelic acid tropine ester hydrobromide
- (±)-Homatropine bromide
- Homatropine bromide
- Isopto homatropine
Work with Homatropine hydrobromide
Similar compounds
(±)-Homatropine87-00-393 % similar
Hyoscyamine hydrobromide306-03-673 % similar
(-)-Atropine101-31-567 % similar
(±)-Atropine51-55-867 % similar
Hyoscyamine hydrochloride5934-50-963 % similar
Atropine sulfate55-48-159 % similar
Hyoscyamine sulfate620-61-159 % similar
Homatropine methobromide80-49-957 % similar
Tanimoto similarity of circular fingerprints over the whole catalogue. All similar compounds