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Substance Name: N,N-Diethyl-2-chloroethylamine
RN: 100-35-6
UNII: BKE4K6N7IF
InChIKey: YMDNODNLFSHHCV-UHFFFAOYSA-N

Classification Codes

  • Drug / Therapeutic Agent
  • Mutation Data
  • Skin / Eye Irritant

Molecular Formula

  • C6-H14-Cl-N

Molecular Weight

  • 135.637
 
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Names and Synonyms

Name of Substance

  • N,N-Diethyl-2-chloroethylamine

Synonyms

  • (2-Chloroethyl)diethylamine
  • 2-(Diethylamino)chloroethane
  • 2-(Diethylamino)ethyl chloride
  • 2-Chlorotriethylamine
  • 4-04-00-00447 (Beilstein Handbook Reference)
  • beta-Chlorotriethylamine
  • BRN 0605300
  • Diethyl(2-chloroethyl)amine
  • Diethylaminoethyl chloride
  • EINECS 202-843-1
  • N-(2-Chloroethyl)diethylamine
  • N-Diethylaminoethyl chloride
  • UNII-BKE4K6N7IF

Systematic Names

  • 2-Chloroethyldiethylamine
  • Triethylamine, 2-chloro-

Registry Numbers

CAS Registry Number

  • 100-35-6

FDA UNII

  • BKE4K6N7IF

Related Registry Numbers

  • 67845-39-0 (sulfate [1:1])
  • 68391-41-3 (sulfate [2:1])
  • 869-24-9 (hydrochloride)

System Generated Number

  • 0000100356

Structure Descriptors

InChI

1S/C6H14ClN/c1-3-8(4-2)6-5-7/h3-6H2,1-2H3

InChIKey

YMDNODNLFSHHCV-UHFFFAOYSA-N

Smiles

N(CCCl)(CC)CC

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
rabbit LD50 skin 300uL/kg (0.3mL/kg)   AMA Archives of Industrial Hygiene and Occupational Medicine. Vol. 4, Pg. 119, 1951.
rat LD50 oral 17mg/kg (17mg/kg)   AMA Archives of Industrial Hygiene and Occupational Medicine. Vol. 4, Pg. 119, 1951.
rat LD50 unreported 30mg/kg (30mg/kg)   Pharmaceutical Bulletin. Vol. 1, Pg. 297, 1953.