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Substance Name: 2,3-Dichloropropanol
RN: 616-23-9
UNII: 88I7UKE7IM
InChIKey: ZXCYIJGIGSDJQQ-UHFFFAOYSA-N

Classification Codes

  • Mutation Data
  • Skin / Eye Irritant

Molecular Formula

  • C3-H6-Cl2-O

Molecular Weight

  • 128.985
 
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Names and Synonyms

Name of Substance

  • 2,3-Dichloro-1-propanol
  • 2,3-Dichloropropanol

Synonyms

  • 1,2-Dichloro-3-propanol
  • 1-Propanol, 2,3-dichloro-
  • 2,3-Dichloro-1-propanol
  • 2,3-Dichloropropanol
  • 2,3-Dichloropropyl alcohol
  • 4-01-00-01442 (Beilstein Handbook Reference)
  • AI3-61542
  • alpha,beta-Dichlorohydrin
  • BRN 1732060
  • CCRIS 954
  • EINECS 210-470-0
  • Glycerol 1,2-dichlorohydrin
  • Glycerol alpha,beta-dichlorohydrin
  • HSDB 2743
  • UNII-88I7UKE7IM

Systematic Names

  • 1-Propanol, 2,3-dichloro-
  • 2,3-Dichloropropan-1-ol

Superlist Name

  • 1-Propanol, 2,3-dichloro-

Registry Numbers

CAS Registry Number

  • 616-23-9

FDA UNII

  • 88I7UKE7IM

Other Registry Number

  • 82890-22-0

System Generated Number

  • 0000616239

Structure Descriptors

InChI

InChI=1S/C3H6Cl2O/c4-1-3(5)2-6/h3,6H,1-2H2

InChIKey

ZXCYIJGIGSDJQQ-UHFFFAOYSA-N

Smiles

OCC(Cl)CCl

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
rabbit LD50 skin 200mg/kg (200mg/kg)   Journal of Industrial Hygiene and Toxicology. Vol. 30, Pg. 63, 1948.
rat LCLo inhalation 500ppm/4H (500ppm)   Journal of Industrial Hygiene and Toxicology. Vol. 31, Pg. 343, 1949.
rat LD50 oral 90mg/kg (90mg/kg)   Journal of Industrial Hygiene and Toxicology. Vol. 30, Pg. 63, 1948.

Physical Properties

Physical Property Value Units Temp (deg C) Source
Boiling Point 184 deg C   EXP
log P (octanol-water) 0.780 (none)   EST
Water Solubility 6.42E+04 mg/L 25 EST
Vapor Pressure 0.184 mm Hg 25 EST
Henry's Law Constant 3.60E-09 atm-m3/mole 25 EST
Atmospheric OH Rate Constant 1.77E-12 cm3/molecule-sec 25 EST

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