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Substance Name: 1,3-Dichloro-2-propanol
RN: 96-23-1
UNII: 0F4P2VQC07
InChIKey: DEWLEGDTCGBNGU-UHFFFAOYSA-N

Classification Codes

  • Cross-Linking Reagents
  • Indicators and Reagents
  • Mutagens
  • Mutation Data
  • Noxae
  • Skin / Eye Irritant
  • Tumor Data

Molecular Formula

  • C3-H6-Cl2-O

Molecular Weight

  • 128.985
 
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Names and Synonyms

Name of Substance

  • 1,3-Dichloro-2-propanol

Synonyms

  • 1,3-Dichloro-2-hydroxypropane
  • 1,3-Dichloro-2-propanol
  • 1,3-Dichlorohydrin
  • 1,3-Dichloroisopropanol
  • 1,3-Dichloroisopropyl alcohol
  • 1,3-Dichloropropanol
  • 2-Propanol, 1-3-dichloro-
  • 4-01-00-01491 (Beilstein Handbook Reference)
  • AI3-14899
  • alpha-Propenyldichlorohydrin
  • BRN 1732063
  • CCRIS 953
  • Dichlorohydrin
  • EC 202-491-9
  • EINECS 202-491-9
  • Enodrin
  • Gdch
  • Glycerol 1,3-dichlorohydrin
  • Glycerol alpha,gamma-dichlorohydrin
  • HSDB 5302
  • NSC 70982
  • Propylene dichlorohydrin
  • s-Dichloroisopropyl alcohol
  • s-Glycerol dichlorohydrin
  • Sym-dichloroisopropyl alcohol
  • Sym-glycerol dichlorohydrin
  • U 25,354
  • UNII-0F4P2VQC07

Systematic Names

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

Superlist Names

  • 1,3-Dichloro-2-propanol
  • 2-Propanol, 1,3-dichloro-

Registry Numbers

CAS Registry Number

  • 96-23-1

FDA UNII

  • 0F4P2VQC07

Other Registry Number

  • 148584-48-9

System Generated Number

  • 0000096231

Structure Descriptors

InChI

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

InChIKey

DEWLEGDTCGBNGU-UHFFFAOYSA-N

Smiles

C(CCl)(CCl)O

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 oral 25mg/kg (25mg/kg)   EHP, Environmental Health Perspectives. Vol. 69, Pg. 203, 1986.
rabbit LD50 skin 800uL/kg (0.8mL/kg)   American Industrial Hygiene Association Journal. Vol. 23, Pg. 95, 1962.
rat LCLo inhalation 125ppm/4H (125ppm)   American Industrial Hygiene Association Journal. Vol. 23, Pg. 95, 1962.
rat LD50 oral 110mg/kg (110mg/kg)   American Industrial Hygiene Association Journal. Vol. 23, Pg. 95, 1962.
rat LDLo intraperitoneal 70mg/kg (70mg/kg) LIVER: "HEPATITIS (HEPATOCELLULAR NECROSIS), ZONAL"

BEHAVIORAL: SOMNOLENCE (GENERAL DEPRESSED ACTIVITY)
Human & Experimental Toxicology. Vol. 16, Pg. 262, 1997.

Physical Properties

Physical Property Value Units Temp (deg C) Source
Melting Point -4.00E+00 deg C   EXP
Boiling Point 176 deg C   EXP
log P (octanol-water) 0.780 (none)   EST
Water Solubility 9.90E+04 mg/L 19 EXP
Vapor Pressure 0.75 mm Hg 20 EXP
Henry's Law Constant 1.29E-06 atm-m3/mole 25 EST
Atmospheric OH Rate Constant 1.89E-12 cm3/molecule-sec 25 EST

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