| CAS Number | 38059-78-8 |
| Catalog Number | AG00C9AP(AGN-PC-0RFEGO) |
| Chemical Name | 4-amino-5-chloro-N-[2-(diethylamino)ethyl]-2-hydroxybenzamide hydrochloride |
| IUPAC Name | 4-amino-5-chloro-N-[2-(diethylamino)ethyl]-2-hydroxybenzamide;hydrochloride |
| InChI | InChI=1S/C13H20ClN3O2.ClH/c1-3-17(4-2)6-5-16-13(19)9-7-10(14)11(15)8-12(9)18;/h7-8,18H,3-6,15H2,1-2H3,(H,16,19);1H |
| InChI Key | JXIGWAINVIWPQD-UHFFFAOYSA-N |
| MDL Number | MFCD00488127 |
| Molecular Formula | C13H21Cl2N3O2 |
| Molecular Weight | 322.2307 |
| SMILES | Cl.CCN(CCNC(C1=C(O)C=C(N)C(Cl)=C1)=O)CC |
| Synonyms | O-Desmethyl Metoclopramide Hydrochloride,
38059-78-8,
JXIGWAINVIWPQD-UHFFFAOYSA-N,
SCHEMBL8746145,
DTXSID40556132,
ACM38059788,
FT-0666181,
4-amino-5-chloro-N-[2(diethylamino)ethyl]-2-hydroxybenzamide hydrochloride,
4-Amino-5-chloro-N-[2-(diethylamino)ethyl]-2-hydroxybenzamide Hydrochlorid,
4-amino-5-chloro-N-[2-(diethylamino)ethyl]-2-hydroxybenzamide hydrochloride,
4-amino-5-chloro-N-[2-(diethylamino)ethyl]2-hydroxybenzamide hydrochloride,
4-amino-5-chloro-N-[2-(diethylamino)-ethyl]-2-hydroxybenzamide hydrochloride,
4-Amino-5-chloro-N-[2-(diethylamino)ethyl]-2-hydroxy-benzamide Hydrochloride,
4-Amino-5-chloro-N-[2-(diethylamino)ethyl]-2-hydroxybenz amide Hydrochloride,
4-Amino-5-chloro-N-[2-(diethylamino)ethyl]-2-hydroxybenzamide--hydrogen chloride (1/1),
|
| Complexity | 287 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 2 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 321.101g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 20 |
| Hydrogen Bond Acceptor Count | 4 |
| Hydrogen Bond Donor Count | 4 |
| Isotope Atom Count | 0 |
| Molecular Weight | 322.23g/mol |
| Monoisotopic Mass | 321.101g/mol |
| Rotatable Bond Count | 6 |
| Topological Polar Surface Area | 78.6A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
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Certificate of Analysis
Lot Number