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Substance Name: 4-(2-Butenyl)phenol
RN: 13037-71-3
UNII: E73YFW4Z77
InChIKey: CHQPRDVSUIJJNP-NSCUHMNNSA-N

Molecular Formula

  • C10-H12-O

Molecular Weight

  • 148.204
 
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Names and Synonyms

Name of Substance

  • 4-(2-Butenyl)phenol

Synonyms

  • 4-(2-Butenyl)phenol
  • AI3-22175
  • BRN 2241201
  • NSC 19678
  • p-2-Butenylphenol
  • p-Crotylphenol
  • UNII-E73YFW4Z77

Systematic Names

  • Phenol, 4-(2-butenyl)-
  • Phenol, 4-(2-butenyl)- (9CI)
  • Phenol, p-2-butenyl-

Registry Numbers

CAS Registry Number

  • 13037-71-3

FDA UNII

  • E73YFW4Z77

System Generated Number

  • 0013037713

Structure Descriptors

InChI

1S/C10H12O/c1-2-3-4-9-5-7-10(11)8-6-9/h2-3,5-8,11H,4H2,1H3/b3-2+

InChIKey

CHQPRDVSUIJJNP-NSCUHMNNSA-N

Smiles

c1(ccc(O)cc1)C\C=C\C

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LDLo intraperitoneal 250mg/kg (250mg/kg)   "Summary Tables of Biological Tests," National Research Council Chemical-Biological Coordination Center. Vol. 8, Pg. 744, 1956.

Physical Properties

Physical Property Value Units Temp (deg C) Source
log P (octanol-water) 3.320 (none)   EST
Water Solubility 431 mg/L 25 EST
Vapor Pressure 5.74E-03 mm Hg 25 EST
Henry's Law Constant 1.27E-06 atm-m3/mole 25 EST
Atmospheric OH Rate Constant 9.82E-11 cm3/molecule-sec 25 EST

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