CAS: 906352-84-9 | 4-(4-Methylhomopiperazin-1-yl)benzoic acid monohydrochloride monohydrate, >95%, NX68053
SKU: NX68053-250MG
Product Identifiers
Catalog # | NX68053 |
CAS Number | 906352-84-9 |
PubChem CID | 18525908 |
Chemical Name | 4-(4-Methylhomopiperazin-1-yl)benzoic acid monohydrochloride monohydrate |
IUPAC Name | 4-(4-methyl-1,4-diazepan-1-yl)benzoic acid;hydrate;hydrochloride |
Synonym | 4-(4-Methyl-1,4-diazepan-1-yl)benzoic acid monohydrochloride monohydrate, 1-(4-Carboxyphenyl)-4-methylhomopiperazine monochloride monohydrate |
InChI | InChI=1S/C13H18N2O2.ClH.H2O/c1-14-7-2-8-15(10-9-14)12-5-3-11(4-6-12)13(16)17;;/h3-6H,2,7-10H2,1H3,(H,16,17);1H;1H2 |
InChIKey | QVHUNXKNQMMJPK-UHFFFAOYSA-N |
SMILES | O.Cl.CN1CCCN(CC1)c2ccc(cc2)C(=O)O |
MDL Number | MFCD08741428 |
Specification
MW | 288.77 |
MF | C13H21ClN2O3 |
Assay | >95% |
Cat Number | OR2080 |
Manufacturer | Apollo Scientific |
Country of Origin | United Kingdom |