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Substance Name: 2-Nonanone
RN: 821-55-6
UNII: ZE5K73YN2Z
InChIKey: VKCYHJWLYTUGCC-UHFFFAOYSA-N
Molecular Formula
- C9-H18-O
Molecular Weight
- 142.2402
- All
- Links to Resources
- Names & Synonyms
- Registry Numbers
- Structure Descriptors
- Toxicity
- Physical Properties
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Names and Synonyms
Name of Substance
- 2-Nonanone
Synonyms
- 2-Nonanone (natural)
- 4-01-00-03353 (Beilstein Handbook Reference)
- beta-Nonanone
- BRN 1743645
- EINECS 212-480-0
- FEMA No. 2785
- Heptyl methyl ketone
- Ketone, heptyl methyl
- Methyl heptyl ketone
- METHYL N-HEPTYL KETONE
- Nonan-2-one
- NSC 14760
- UNII-ZE5K73YN2Z
Systematic Name
- 2-Nonanone
Superlist Names
- 2-Nonanone
- Methyl heptyl ketone
Registry Numbers
CAS Registry Number
- 821-55-6
FDA UNII
- ZE5K73YN2Z
System Generated Number
- 0000821556
Structure Descriptors
InChI
1S/C9H18O/c1-3-4-5-6-7-8-9(2)10/h3-8H2,1-2H3InChIKey
VKCYHJWLYTUGCC-UHFFFAOYSA-NSmiles
C(CCCCC)Toxicity
Organism | Test Type | Route | Reported Dose (Normalized Dose) | Effect | Source |
---|---|---|---|---|---|
mouse | LD50 | oral | 7994mg/kg (7994mg/kg) | Toxicology Letters. Vol. 30, Pg. 13, 1986. | |
rabbit | LD50 | skin | > 5gm/kg (5000mg/kg) | Food and Chemical Toxicology. Vol. 26, Pg. 393, 1988. | |
rat | LC | inhalation | > 3980mg/m3/6H (3980mg/m3) | Kodak Company Reports. Vol. 21MAY1971, | |
rat | LD50 | oral | 3200mg/kg (3200mg/kg) | Kodak Company Reports. Vol. 21MAY1971, |
Physical Properties
Physical Property | Value | Units | Temp (deg C) | Source |
---|---|---|---|---|
Melting Point | -7.50E+00 | deg C | EXP | |
Boiling Point | 195.3 | deg C | EXP | |
log P (octanol-water) | 3.14 | (none) | EXP | |
Water Solubility | 371 | mg/L | 25 | EXP |
Vapor Pressure | 0.624 | mm Hg | 25 | EXP |
Henry's Law Constant | 3.67E-04 | atm-m3/mole | 25 | EXP |
Atmospheric OH Rate Constant | 1.22E-11 | cm3/molecule-sec | 25 | EXP |
Physical property data is provided to ChemIDplus by SRC, Inc.