Skip Navigation
ChemIDplus Lite•Browse•Advanced

Substance Name: Myrtenal
RN: 564-94-3
UNII: 8J97443QRZ
InChIKey: KMRMUZKLFIEVAO-IUCAKERBSA-N

Molecular Formula

  • C10-H14-O

Molecular Weight

  • 150.2196
 
* denotes mobile formatted website

Links to Resources

NLM Resources (File Locators)

Regulatory Agencies (Superlist Locators)

Other Resources (Internet Locators)


Search for this InChIKey on the Web

Names and Synonyms

Name of Substance

  • Myrtenal

Synonyms

  • 2-Formyl-6,6-dimethylbicyclo(3.1.1)hept-2-ene
  • 2-Norpinene-2-carboxaldehyde, 6,6-dimethyl-
  • 6,6-Dimethyl-2-norpinene-2-carboxaldehyde
  • 6,6-Dimethylbicyclo(3.1.1)hept-2-ene-2-carboxaldehyde
  • Benihinal
  • Bicyclo(3.1.1)hept-2-ene-2-carboxaldehyde, 6,6-dimethyl-
  • EINECS 209-274-8
  • FEMA No. 3395
  • Myrtenal
  • NSC 54384
  • UNII-8J97443QRZ

Systematic Names

  • 2-Norpinene-2-carboxaldehyde, 6,6-dimethyl- (8CI)
  • Bicyclo(3.1.1)hept-2-ene-2-carboxaldehyde, 6,6-dimethyl-
  • Pin-2-ene-1-carbaldehyde

Superlist Name

  • Myrtenal

Registry Numbers

CAS Registry Number

  • 564-94-3

FDA UNII

  • 8J97443QRZ

Other Registry Number

  • 57526-63-3

System Generated Number

  • 0000564943

Structure Descriptors

InChI

InChI=1S/C10H14O/c1-10(2)8-4-3-7(6-11)9(10)5-8/h3,6,8-9H,4-5H2,1-2H3/t8-,9-/m0/s1

InChIKey

KMRMUZKLFIEVAO-IUCAKERBSA-N

Smiles

CC1(C)[C@H]2CC=C(C=O)[C@@H]1C2

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 intravenous 170mg/kg (170mg/kg)   Food and Chemical Toxicology. Vol. 26, Pg. 329, 1988.
rabbit LD50 skin > 5gm/kg (5000mg/kg)   Food and Chemical Toxicology. Vol. 26, Pg. 329, 1988.
rat LD50 oral 2300mg/kg (2300mg/kg)   Food and Chemical Toxicology. Vol. 26, Pg. 329, 1988.

Physical Properties

Physical Property Value Units Temp (deg C) Source
Boiling Point 220.5 deg C   EXP
log P (octanol-water) 2.98 (none)   EXP

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