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Substance Name: 4-Butylmorpholine
RN: 1005-67-0
UNII: 9QV4M0PWHM
InChIKey: LMRKVKPRHROQRR-UHFFFAOYSA-N

Classification Codes

  • Skin / Eye Irritant
  • TSCA Flag P (a Commenced PMN (Premanufacture Notice) Substance)

Molecular Formula

  • C8-H17-N-O

Molecular Weight

  • 143.228
 
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Names and Synonyms

Name of Substance

  • 4-Butylmorpholine

Synonyms

  • 4-27-00-00026 (Beilstein Handbook Reference)
  • 4-Butylmorpholine
  • BRN 0103953
  • N-(n-Butyl)morpholine
  • N-Butylmorpholine
  • NSC 28457
  • RTECS QN6328000
  • UNII-9QV4M0PWHM

Systematic Name

  • Morpholine, 4-butyl-

Registry Numbers

CAS Registry Number

  • 1005-67-0

FDA UNII

  • 9QV4M0PWHM

System Generated Number

  • 0001005670

Structure Descriptors

InChI

1S/C8H17NO/c1-2-3-4-9-5-7-10-8-6-9/h2-8H2,1H3

InChIKey

LMRKVKPRHROQRR-UHFFFAOYSA-N

Smiles

CCCCN1CCOCC1

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
rabbit LD50 skin 1800mg/kg (1800mg/kg) SKIN AND APPENDAGES (SKIN): CORROSIVE: AFTER TOPICAL EXPOSURE Acute Toxicity Data. Journal of the American College of Toxicology, Part B. Vol. 1, Pg. 13, 1990.
rat LD50 oral 338mg/kg (338mg/kg) GASTROINTESTINAL: OTHER CHANGES Acute Toxicity Data. Journal of the American College of Toxicology, Part B. Vol. 1, Pg. 13, 1990.

Physical Properties

Physical Property Value Units Temp (deg C) Source
Melting Point -5.71E+01 deg C   EXP
Boiling Point 213.5 deg C   EXP
log P (octanol-water) 1.130 (none)   EST
Atmospheric OH Rate Constant 1.54E-10 cm3/molecule-sec 25 EST

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