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Substance Name: Diethylcarbamoyl chloride
RN: 88-10-8
UNII: 5RIV1U6H5W
InChIKey: OFCCYDUUBNUJIB-UHFFFAOYSA-N

Classification Codes

  • Skin / Eye Irritant
  • Tumor Data

Molecular Formula

  • C5-H10-Cl-N-O

Molecular Weight

  • 135.593
 
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Names and Synonyms

Name of Substance

  • Diethylcarbamoyl chloride

Synonyms

  • 4-04-00-00379 (Beilstein Handbook Reference)
  • BRN 0506687
  • Carbamic chloride, diethyl-
  • Carbamidoyl chloride, diethyl-
  • Carbamoyl chloride, diethyl-
  • Diethylamid kyseliny chlormravenci
  • Diethylamid kyseliny chlormravenci [Czech]
  • Diethylcarbamic chloride
  • Diethylcarbamoyl chloride
  • Diethylcarbamyl chloride
  • Diethylchloroformamide
  • EINECS 201-798-5
  • HSDB 2657
  • N,N-Diethylcarbamoyl chloride
  • N,N-Diethylchloroformamide
  • NSC 223067
  • UNII-5RIV1U6H5W

Systematic Names

  • Carbamic chloride, diethyl-
  • Carbamic chloride, N,N-diethyl-
  • Carbamoyl chloride, diethyl-
  • Diethylcarbamoyl chloride

Superlist Names

  • Carbamic chloride, diethyl-
  • Diethylcarbamyl chloride

Registry Numbers

CAS Registry Number

  • 88-10-8

FDA UNII

  • 5RIV1U6H5W

System Generated Number

  • 0000088108

Structure Descriptors

InChI

InChI=1S/C5H10ClNO/c1-3-7(4-2)5(6)8/h3-4H2,1-2H3

InChIKey

OFCCYDUUBNUJIB-UHFFFAOYSA-N

Smiles

CCN(CC)C(=O)Cl

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 intraperitoneal 750mg/kg (750mg/kg)   National Technical Information Service. Vol. AD691-490,
rabbit LDLo skin 12840mg/kg (12840mg/kg) SKIN AND APPENDAGES (SKIN): "DERMATITIS, OTHER: AFTER SYSTEMIC EXPOSURE" National Technical Information Service. Vol. OTS0571246,
rat LCLo inhalation 159ppm/7H (159ppm)   National Technical Information Service. Vol. OTS0571246,
rat LD50 oral 2700mg/kg (2700mg/kg) GASTROINTESTINAL: ALTERATION IN GASTRIC SECRETION

BEHAVIORAL: COMA

BLOOD: CHANGES IN SPLEEN
National Technical Information Service. Vol. OTS0571246,

Physical Properties

Physical Property Value Units Temp (deg C) Source
Melting Point -3.20E+01 deg C   EXP
Boiling Point 186 deg C   EXP
log P (octanol-water) 0.260 (none)   EST
Water Solubility 5.24E+04 mg/L 25 EST
Vapor Pressure 0.721 mm Hg 25 EST
Henry's Law Constant 1.28E-06 atm-m3/mole 25 EST
Atmospheric OH Rate Constant 2.30E-11 cm3/molecule-sec 25 EST

Physical property data is provided to ChemIDplus by SRC, Inc.