Compound Summary


  Compound Information
 39959-66-5

Compound Name:

39959-66-5

Compound CID:

11957540

Synonyms:

39959-66-5

LY 78335

1-(2,3-Dichlorophenyl)ethanamine hydrochloride

1-(2,3-DICHLOROPHENYL)ETHAN-1-AMINE HYDROCHLORIDE

1-(2,3-dichlorophenyl)ethanamine;hydrochloride

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Iupac Name:

1-(2,3-dichlorophenyl)ethanamine;hydrochloride

InChI:

InChI=1S/C8H9Cl2N.ClH/c1-5(11)6-3-2-4-7(9)8(6)10;/h2-5H,11H2,1H3;1H

InChIKey:

FQTXPVLCCDQRHY-UHFFFAOYSA-N

Canonical Smiles:

CC(C1=C(C(=CC=C1)Cl)Cl)N.Cl

Isomeric Smiles:

CC(C1=C(C(=CC=C1)Cl)Cl)N.Cl

Molecular Weight:

226.5

Molecular Formula:

C8H10Cl3N

  Compound Structure
 2D Structure:
 3D Structure:
  Computed Properties
 39959-66-5

Molecular Weight:

226.5

Molecular Formula:

C8H10Cl3N

Hydrogen Bond Donor Count:

2

Hydrogen Bond Acceptor Count:

1

Rotatable Bond Count:

1

Heavy Atom Count:

12

Complexity:

129

  Synonyms
 39959-66-5

39959-66-5 39959-66-5

39959-66-5

LY 78335

1-(2,3-Dichlorophenyl)ethanamine hydrochloride

1-(2,3-DICHLOROPHENYL)ETHAN-1-AMINE HYDROCHLORIDE

1-(2,3-dichlorophenyl)ethanamine;hydrochloride

LY 78335 hydrochloride

(+/-)-2,3-Dichloro-alpha-methylbenzylamine hydrochloride

EU-0100476

SCHEMBL1321451

CHEMBL1255749

DTXSID80474684

DCMB hydrochloride; LY-78335

Tox21_500476

MFCD00055225

AKOS024457957

CCG-221780

LP00476

NCGC00093885-01

NCGC00093885-02

NCGC00261161-01

DS-19653

CS-0028369

D-103

2,3-Dichloro-?-methylbenzylamine hydrochloride

F16890

1-(2,3-DICHLOROPHENYL)ETHAN-1-AMINE HCL

SR-01000075609

SR-01000075609-1

(?)-2,3-Dichloro-alpha-methylbenzylamine hydrochloride

(y)-2,3-Dichloro-alpha-methylbenzylamine hydrochloride

( inverted question mark)-2,3-Dichloro-alpha-methylbenzylamine hydrochloride

  Experimental Data
 39959-66-5

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 3 NS N2 24134630 Inactive
  Experimental Data Visualization
 39959-66-5

  Statistics Data
 39959-66-5

Species Lifespan Change(AVG/MED%) Lifespan Change(MAX%) Count Reference Count Data point
Caenorhabditis elegans 3 1 1
  Statistics Data Visualization
 39959-66-5