Products for Research Use Only
RegisterLogin

Butropium Bromide

CAT: 0572-TRC-B690080-5MGSize: 5 mgDry Ice: NoHazardous: No
Product image 1
1 / 1
CAT#:0572-TRC-B690080-5MGSize:5 mg
Selected
24/48H Stock Items & 2 to 6 Weeks non Stock Items.
Quick Request Actions
CAS Number
29025-14-7
Synonyms
8-Azoniabicyclo[3.2.1]octane, 8-[(4-butoxyphenyl)methyl]-3-[(2S)-3-hydroxy-1-oxo-2-phenylpropoxy]-8-methyl-, bromide (1:1), (3-endo)-; 1αH,5αH-Tropanium, 8-(p-butoxybenzyl)-3α-hydroxy-, bromide, (-)-tropate (8CI); 8-Azoniabicyclo[3.2.1]octane, 8-[(4-butoxyphenyl)methyl]-3-(3-hydroxy-1-oxo-2-phenylpropoxy)-8-methyl-, bromide, [3(S)-endo]- (9CI); (p-Butoxybenzyl)hyoscyaminium bromide; BHB; Butropium bromide; Coliopan; N-(Butoxybenzyl)hyoscyamine bromide
Hazard Statement
Harmful if swallowed.
Purity
>95% (HPLC)
Smiles
[Br-].CCCCOc1ccc(C[N+]2(C)[C@@H]3CC[C@H]2C[C@H](C3)OC(=O)[C@H](CO)c4ccccc4)cc1
Molecular Formula
C28 H38 N O4 . Br
Molecular Weight
532.51
InChI
InChI=1S/C28H38NO4.BrH/c1-3-4-16-32-25-14-10-21(11-15-25)19-29(2)23-12-13-24(29)18-26(17-23)33-28(31)27(20-30)22-8-6-5-7-9-22;/h5-11,14-15,23-24,26-27,30H,3-4,12-13,16-20H2,1-2H3;1H/q+1;/p-1/t23-,24+,26+,27-,29?;/m1./s1
Additionnal Information
IUPAC name: [(1R,5S)-8-[(4-butoxyphenyl)methyl]-8-methyl-8-azoniabicyclo[3.2.1]octan-3-yl] (2S)-3-hydroxy-2-phenylpropanoate;bromide
Shipping Conditions
Room Temperature
Storage Conditions
+4°C

Chemical Information

Butropium bromide

Butropium bromide is an organic bromide salt of butropium. It is a drug which suppresses spasm of smooth muscles of internal organs, inhibits gastric acid secretion and relieves abdominal pain. It is used in the treatment of spasmodic pains associated with gastritis, gastric ulcers and cholelithiasis. It has a role as a muscarinic antagonist and an antispasmodic drug. It is a quaternary ammonium salt and an organic bromide salt. It contains a butropium.

CAS Number29025-14-7
PubChem CID656592
IUPAC Name[(1S,5R)-8-[(4-butoxyphenyl)methyl]-8-methyl-8-azoniabicyclo[3.2.1]octan-3-yl] (2S)-3-hydroxy-2-phenylpropanoate bromide
Molecular FormulaC28H38BrNO4
Molecular Weight532.5
Topological Polar Surface Area55.8
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count5
Rotatable Bond Count11
Heavy Atom Count34
Formal Charge0
Complexity597
SMILES
CCCCOC1=CC=C(C=C1)C[N+]2([C@@H]3CC[C@H]2CC(C3)OC(=O)[C@H](CO)C4=CC=CC=C4)C.[Br-]
InChI
InChI=1S/C28H38NO4.BrH/c1-3-4-16-32-25-14-10-21(11-15-25)19-29(2)23-12-13-24(29)18-26(17-23)33-28(31)27(20-30)22-8-6-5-7-9-22;/h5-11,14-15,23-24,26-27,30H,3-4,12-13,16-20H2,1-2H3;1H/q+1;/p-1/t23-,24+,26?,27-,29?;/m1./s1
InChIKey
JABDOYKGZCPHPX-LVJITLAUSA-M
Chemical Structure
2D Structure
2D structure of Butropium bromide
CAS: 29025-14-7
CID: 656592
Formula: C28H38BrNO4
MW: 532.5
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight532.5
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count5
Rotatable Bond Count11
Exact Mass531.19842
Monoisotopic Mass531.19842
Topological Polar Surface Area55.8 Ų
Heavy Atom Count34
Formal Charge0
Complexity597
Isotope Atom Count0
Defined Atom Stereocenter Count3
Undefined Atom Stereocenter Count0
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
Covalently-Bonded Unit Count2
Compound Is CanonicalizedYes

Related Products

CatalogName
TRC-O293250-500MGOctylonium Bromide
TRC-C588670-25MGClopidogrel Bromide
TRC-P336825-5GPhenylselenyl Bromide
TRC-C382610-500MGHexyltriphenylphosphonium Bromide
TRC-M223750-5GMepenzolate Bromide
TRC-S465055-100MGSilver Bromide
TRC-D212453-10GDecamethonium Bromide
TRC-P465000-10MGPinaverium Bromide
TRC-P717500-100MGPrifinium Bromide
TRC-P465000-100MGPinaverium Bromide

Alternative Products

CatalogName
FB19431-01Butropium bromide
HY-122548Butropium (bromide)
sc-217807Butropium Bromide-d9
29309654-500gHexadecyltrimethylammonium bromide (Cetyltrimethylammonium bromide)
CB0105Cetyldimethylethyl ammonium bromide (Ethylhexadecyldimethylammonium bromide)
AR-I03852-01Ipratropium Bromide Impurity 11 Bromide
AR-U01225-01Umeclidinium Bromide Impurity 6 Bromide
AR-R11297-01Rocuronium Bromide Impurity 7 Bromide
O5553-02Octylonium Bromide (Spasmonen. Otilonium Bromide)
AR-I03850-01Ipratropium Bromide Impurity 6 Bromide

Popular Products