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Substance Name: 4-Chlorobutyryl chloride
RN: 4635-59-0
UNII: 3663U0VKRI
InChIKey: CDIIZULDSLKBKV-UHFFFAOYSA-N

Molecular Formula

  • C4-H6-Cl2-O

Molecular Weight

  • 140.9964
 
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Names and Synonyms

Name of Substance

  • 4-Chlorobutyryl chloride

Synonyms

  • 4-Chlorobutanoic acid chloride
  • 4-Chlorobutanoyl chloride
  • 4-Chlorobutyric acid chloride
  • 4-Chlorobutyroyl chloride
  • 4-Chlorobutyryl chloride
  • Butyryl chloride, 4-chloro-
  • EC 225-059-1
  • EINECS 225-059-1
  • gamma-Chlorobutyroyl chloride
  • gamma-Chlorobutyryl chloride
  • HSDB 7299
  • UNII-3663U0VKRI

Systematic Names

  • 4-Chlorobutyryl chloride
  • Butanoyl chloride, 4-chloro-

Registry Numbers

CAS Registry Number

  • 4635-59-0

FDA UNII

  • 3663U0VKRI

System Generated Number

  • 0004635590

Structure Descriptors

InChI

1S/C4H6Cl2O/c5-3-1-2-4(6)7/h1-3H2

InChIKey

CDIIZULDSLKBKV-UHFFFAOYSA-N

Smiles

O=C(CCCCl)Cl

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
rat LC50 inhalation 650mg/m3/4H (650mg/m3) LUNGS, THORAX, OR RESPIRATION: RESPIRATORY DEPRESSION

SKIN AND APPENDAGES (SKIN): HAIR: OTHER
National Technical Information Service. Vol. OTS0570772,

Physical Properties

Physical Property Value Units Temp (deg C) Source
Boiling Point 173.5 deg C   EXP
log P (octanol-water) 0.760 (none)   EST
Atmospheric OH Rate Constant 1.82E-12 cm3/molecule-sec 25 EST

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