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Benzoic acid, 4-amino-2-hydroxy-, compd. with N,N-dimethyl-gamma-phenyl-2-pyridinepropanamine (1:1)

HCID 92952
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Basic information

CAS
2508-73-8
Standard SMILES
CN(C)CCC(c1ccccc1)c1ccccn1.Nc1ccc(C(=O)O)c(O)c1
InChIKey
OJAJSEABEYJWLC-UHFFFAOYSA-N
Molecular formula
C23H27N3O3
Average molar mass
393.5 g/mol
Monoisotopic mass
393.20524173

Names & identifiers

Preferred name
Benzoic acid, 4-amino-2-hydroxy-, compd. with N,N-dimethyl-gamma-phenyl-2-pyridinepropanamine (1:1)
IUPAC
4-amino-2-hydroxybenzoic acid;N,N-dimethyl-3-phenyl-3-pyridin-2-ylpropan-1-amine
English name
pheniramine 4-aminosalicylate
Molecular formula
C16H20N2.C7H7NO3
Molecular weight
393.484

Names & synonyms

Pheniramine 4-aminosalicylate3269-83-8RefChem:1079152DTXSID301088272221-888-8Benzoic acid, 4-amino-2-hydroxy-, compd. with N,N-dimethyl-gamma-phenyl-2-pyridinepropanamine (1:1)Pheniramine aminosalicylatePheniramine p-aminosalicylate2508-73-80NA6Q9I2PBEINECS 221-888-8UNII-0NA6Q9I2PB
Show more names
p-AminosalicylatePheniramine-p-aminosalicylateSalicylic acid, 4-amino-, compd. with prophenpyridamine (6ci)Pyridine, 2-(alpha-(2-dimethylamino)ethyl)benzyl-, mixed with p-aminosalicylic acidSalicylic acid, 4-amino-, compd. with 2-(alpha-(2-(dimethylamino)ethyl)benzyl)-, pyridine
DTXSID30947939OJAJSEABEYJWLC-UHFFFAOYSA-N4-amino-2-hydroxybenzoic acid;N,N-dimethyl-3-phenyl-3-pyridin-2-ylpropan-1-aminePHENIRAMINE P-AMINOSALICYLATE [MI]PHENIRAMINE AMINOSALICYLATE [WHO-DD]NS00083367Q272369951-PHENYL-1-(2-PYRIDYL)-3-DIMETHYLAMINOPROPANE P-AMINOSALICYLATE

Properties

Computed structural properties

Topological polar surface area
99.7 Ų
Hydrogen bond donors
3
Hydrogen bond acceptors
6
Rotatable bonds
6
Heavy atoms
29
Formal charge
0
Complexity
381

Physicochemical properties

EWG's Food Scores
1 · 1
FDA UNII
0 NA6Q9I2PB · 0NA6Q9I2PB

Safety & regulation

Safety information is for reference only and does not replace the supplier’s Safety Data Sheet (SDS), applicable regulations, or professional assessment.

Hazard information

Other Safety InformationIMAP assessments - Benzoic acid, 4-amino-2-hydroxy-, compound with N,N-dimethyl-.gamma.-phenyl-2-pyridinepropanamine (1:1): Human health tier I assessment

Related reactions

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Compound notes

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Database identifiers

CAS
2508-73-8、3269-83-8
PubChem CID
92952
DTXSID
DTXSID30947939
UNII
0NA6Q9I2PB
EC Number
221-888-8