Compound Summary


  Compound Information
 Xylometazoline hydrochloride

Compound Name:

Xylometazoline hydrochloride

Compound CID:

5282386

Synonyms:

Xylometazoline hydrochloride

1218-35-5

Xylometazoline HCl

Xylometazoline (hydrochloride)

2-(4-tert-Butyl-2,6-dimethylbenzyl)-2-imidazoline hydrochloride

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Iupac Name:

2-[(4-tert-butyl-2,6-dimethylphenyl)methyl]-4,5-dihydro-1H-imidazole;hydrochloride

InChI:

InChI=1S/C16H24N2.ClH/c1-11-8-13(16(3,4)5)9-12(2)14(11)10-15-17-6-7-18-15;/h8-9H,6-7,10H2,1-5H3,(H,17,18);1H

InChIKey:

YGWFCQYETHJKNX-UHFFFAOYSA-N

Canonical Smiles:

CC1=CC(=CC(=C1CC2=NCCN2)C)C(C)(C)C.Cl

Isomeric Smiles:

CC1=CC(=CC(=C1CC2=NCCN2)C)C(C)(C)C.Cl

Molecular Weight:

280.83

Molecular Formula:

C16H25ClN2

  Compound Structure
 2D Structure:
 3D Structure:
  Computed Properties
 Xylometazoline hydrochloride

Molecular Weight:

280.83

Molecular Formula:

C16H25ClN2

Hydrogen Bond Donor Count:

2

Hydrogen Bond Acceptor Count:

1

Rotatable Bond Count:

3

Heavy Atom Count:

19

Complexity:

302

  Synonyms
 Xylometazoline hydrochloride

Xylometazoline hydrochloride Xylometazoline hydrochloride

Xylometazoline hydrochloride

1218-35-5

Xylometazoline HCl

Xylometazoline (hydrochloride)

2-(4-tert-Butyl-2,6-dimethylbenzyl)-2-imidazoline hydrochloride

MFCD00238707

MLS000069695

UNII-X5S84033NZ

1H-Imidazole, 2-4-(1,1-dimethylethyl)-2,6-dimethylphenylmethyl-4,5-dihydro-, hydrochloride (1:1)

SMR000058526

DSSTox_CID_25223

DSSTox_RID_80760

DSSTox_GSID_45223

2-(4-tert-butyl-2,6-dimethylbenzyl)-4,5-dihydro-1h-imidazole hydrochloride

2-(4-(tert-butyl)-2,6-dimethylbenzyl)-4,5-dihydro-1H-imidazole hydrochloride

X5S84033NZ

Xylometazoline hydrochloride (USP)

2-(4-tert-butyl-2,6-dimethylphenyl)methyl-4,5-dihydro-1H-imidazole;hydrochloride

SR-01000000230

NCGC00016101-02

CAS-1218-35-5

Prestwick_574

Opera_ID_1744

Neo-Synephrine II (TN)

SCHEMBL41837

MLS001076518

SPECTRUM1500614

CHEMBL1256400

DTXSID3045223

REGID_for_CID_5282386

HMS1568N07

HMS1921K09

Pharmakon1600-01500614

Xylometazoline Hydrochloride ,(S)

BCP22148

HY-B0475

Tox21_110305

Tox21_501269

CCG-39900

NSC757378

s2576

AKOS015895456

Tox21_110305_1

AC-8301

KS-5144

LP01269

NSC-757378

NCGC00016101-10

NCGC00094506-01

NCGC00094506-02

NCGC00094506-03

NCGC00094506-04

NCGC00094506-05

NCGC00261954-01

H812

AB0013278

EU-0101269

FT-0603554

SW196748-3

D00757

X 6000

Xylometazoline hydrochloride, analytical standard

218X355

A804796

J-004686

SR-01000000230-2

SR-01000000230-7

Q27293585

Xylometazoline hydrochloride, British Pharmacopoeia (BP) Reference Standard

Xylometazoline hydrochloride, European Pharmacopoeia (EP) Reference Standard

Xylometazoline hydrochloride, Pharmaceutical Secondary Standard; Certified Reference Material

Xylometazoline hydrochloride, United States Pharmacopeia (USP) Reference Standard

  Experimental Data
 Xylometazoline hydrochloride

Species Dosage Unit CG Lifespan(AVG/MED days) TG Lifespan(AVG/MED days) Lifespan Change(AVG/MED%) CG Lifespan(MAX days) TG Lifespan(MAX days) Lifespan Change(MAX%) Significant Strain Gender PubMed Active Label
Caenorhabditis elegans 33 umol/L 7 NS N2 24134630 Inactive
  Experimental Data Visualization
 Xylometazoline hydrochloride

  Statistics Data
 Xylometazoline hydrochloride

Species Lifespan Change(AVG/MED%) Lifespan Change(MAX%) Count Reference Count Data point
Caenorhabditis elegans 7 1 1
  Statistics Data Visualization
 Xylometazoline hydrochloride