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Home Other Building Blocks Roxatidine acetate hydrochloride

Roxatidine acetate hydrochloride

CAS No.:
93793-83-0
Catalog Number:
AG0038J2
Molecular Formula:
C19H29ClN2O4
Molecular Weight:
384.8976
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
25mg
>98%(HPLC)powder
In Stock USA
United States
$87
- +
100mg
>98%(HPLC)powder
In Stock USA
United States
$155
- +
1g
>98%(HPLC)powder
In Stock USA
United States
$447
- +
Product Description
Catalog Number:
AG0038J2
Chemical Name:
Roxatidine acetate hydrochloride
CAS Number:
93793-83-0
Molecular Formula:
C19H29ClN2O4
Molecular Weight:
384.8976
MDL Number:
MFCD00941429
IUPAC Name:
[2-oxo-2-[3-[3-(piperidin-1-ylmethyl)phenoxy]propylamino]ethyl] acetate;hydrochloride
InChI:
InChI=1S/C19H28N2O4.ClH/c1-16(22)25-15-19(23)20-9-6-12-24-18-8-5-7-17(13-18)14-21-10-3-2-4-11-21;/h5,7-8,13H,2-4,6,9-12,14-15H2,1H3,(H,20,23);1H
InChI Key:
FEWCTJHCXOHWNL-UHFFFAOYSA-N
SMILES:
O=C(COC(=O)C)NCCCOc1cccc(c1)CN1CCCCC1.Cl
UNII:
60426GOR1E
NSC Number:
760384
Properties
Complexity:
410  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
2  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
384.182g/mol
Formal Charge:
0
Heavy Atom Count:
26  
Hydrogen Bond Acceptor Count:
5  
Hydrogen Bond Donor Count:
2  
Isotope Atom Count:
0
Molecular Weight:
384.901g/mol
Monoisotopic Mass:
384.182g/mol
Rotatable Bond Count:
10  
Topological Polar Surface Area:
67.9A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
Literature
Title Journal
Microsphere-based protease assays and screening application for lethal factor and factor Xa. Cytometry. Part A : the journal of the International Society for Analytical Cytology 20060501
Properties