Methenamine mandelate

C14H20N4O3CAS 587-23-5292.34 g/mol

NNNNOHOHO
AlcoholCarboxylic acidTertiary amine

Properties

Molecular formula
C14H20N4O3
Molar mass
292.34 g/mol
Exact mass
292.1535 Da
Melting point
129.2–129.5 °C
logP
-0.22Crippen estimate
Polar surface area
70.5 Ų
H-bond donors / acceptors
2 / 6
Rotatable bonds
2

Identifiers

CAS number
587-23-5
SMILES
C1N2CN3CN1CN(C2)C3.O=C(O)C(O)c1ccccc1
InChIKey
UXNFIJPHRQEWRQ-UHFFFAOYSA-N
InChI
InChI=1S/C8H8O3.C6H12N4/c9-7(8(10)11)6-4-2-1-3-5-6;1-7-2-9-4-8(1)5-10(3-7)6-9/h1-5,7,9H,(H,10,11);1-6H2

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Names and synonyms

35 names · show all
  • Benzeneacetic acid, α-hydroxy-, compd. with 1,3,5,7-tetraazatricyclo[3.3.1.13,7]decane (1:1)
  • Mandelic acid, compd. with hexamethylenetetramine (1:1)
  • Mandelic acid, salt with (CH2)6N4
  • Hexamethylenetetramine, compd. with mandelic acid
  • Hexamethylenetetramine, monomandelate
  • 1,3,5,7-Tetraazatricyclo[3.3.1.13,7]decane, mono(α-hydroxybenzeneacetate)
  • Diuramine
  • Hexamethylenetetramine mandelate
  • Hexydaline
  • Mandalay
  • Mandelamine
  • Mantropine
  • Methavin
  • Penelate
  • Uromandelin
  • Uronamin
  • Hexamethylenetetramine phenylglycolate
  • Hexamethyleneamine mandelate
  • Mandurin
  • Reflux
  • Renelate
  • Mandoz
  • Cedulamin
  • Uronamine
  • Mandastat
  • Mandacon
  • Uro-cedulamin
  • Prov-U-sep
  • Mandopan
  • Mandural
  • Mandelic acid methenamine salt
  • Uroqid
  • Hexamethylenamine mandelate
  • Hexamine mandelate
  • 1,3,5,7-Tetraazaadamantane 2-hydroxy-2-phenylacetate

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Similar compounds

Tanimoto similarity of circular fingerprints over the whole catalogue. All similar compounds

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