6-Methylhept-5-en-2-one

Suppliers

Names

[ CAS No. ]:
110-93-0

[ Name ]:
6-Methylhept-5-en-2-one

[Synonym ]:
2-methyl-hept-2-ene-6-one
6-methylhept-5-en-one
6-Methyl-hepten-2-one
6-Methyl-5-hepten-2-one
2-methylhept-2-en-6-one
MFCD00008905
6-methylhept
METHYLHEPTENON
2-Methyl-2-hepten-6-one
5-Hepten-2-one, 6-methyl-
6-methylhept-5-en
6-methylhept-5-en-2-one
FEMA 2707
methyl-5-hepten-2-one
6-methyl-2-keto-hept-5-ene
Prenylacetone
METHYL HEPTENONE
EINECS 203-816-7
6-Methyl-5-heptene-2-one
6-Methyl-D5-hepten-2-one
Methyl hepten
sulcatone

Chemical & Physical Properties

[ Density]:
0.8±0.1 g/cm3

[ Boiling Point ]:
173.3±9.0 °C at 760 mmHg

[ Melting Point ]:
-67.1 °C

[ Molecular Formula ]:
C8H14O

[ Molecular Weight ]:
126.196

[ Flash Point ]:
50.6±0.0 °C

[ Exact Mass ]:
126.104462

[ PSA ]:
17.07000

[ LogP ]:
2.09

[ Vapour Pressure ]:
1.3±0.3 mmHg at 25°C

[ Index of Refraction ]:
1.430

[ Storage condition ]:
Flammables area

[ Water Solubility ]:
insoluble

MSDS

Toxicological Information

CHEMICAL IDENTIFICATION

RTECS NUMBER :
MJ9700000
CHEMICAL NAME :
5-Hepten-2-one, 6-methyl-
CAS REGISTRY NUMBER :
110-93-0
BEILSTEIN REFERENCE NO. :
1741705
LAST UPDATED :
199712
DATA ITEMS CITED :
7
MOLECULAR FORMULA :
C8-H14-O
MOLECULAR WEIGHT :
126.22
WISWESSER LINE NOTATION :
1Y1U3V1

HEALTH HAZARD DATA

ACUTE TOXICITY DATA

TYPE OF TEST :
Standard Draize test
ROUTE OF EXPOSURE :
Administration onto the skin
SPECIES OBSERVED :
Rodent - rabbit
REFERENCE :
FCTXAV Food and Cosmetics Toxicology. (London, UK) V.1-19, 1963-81. For publisher information, see FCTOD7. Volume(issue)/page/year: 13,859,1975 ** ACUTE TOXICITY DATA **
TYPE OF TEST :
LD50 - Lethal dose, 50 percent kill
ROUTE OF EXPOSURE :
Oral
SPECIES OBSERVED :
Rodent - rat
DOSE/DURATION :
3500 mg/kg
TOXIC EFFECTS :
Details of toxic effects not reported other than lethal dose value
REFERENCE :
MDZEAK Medizin und Ernaehrung. (Stuttgart, Fed. Rep. Ger.) V.1-13, 1959-72. Discontinued. Volume(issue)/page/year: 8,244,1967
TYPE OF TEST :
LD50 - Lethal dose, 50 percent kill
ROUTE OF EXPOSURE :
Administration onto the skin
SPECIES OBSERVED :
Rodent - rat
DOSE/DURATION :
>2 gm/kg
TOXIC EFFECTS :
Details of toxic effects not reported other than lethal dose value
REFERENCE :
FCTXAV Food and Cosmetics Toxicology. (London, UK) V.1-19, 1963-81. For publisher information, see FCTOD7. Volume(issue)/page/year: 13,859,1975
TYPE OF TEST :
LD50 - Lethal dose, 50 percent kill
ROUTE OF EXPOSURE :
Oral
SPECIES OBSERVED :
Rodent - mouse
DOSE/DURATION :
2410 mg/kg
TOXIC EFFECTS :
Behavioral - somnolence (general depressed activity) Behavioral - muscle weakness Lungs, Thorax, or Respiration - dyspnea
REFERENCE :
GTPZAB Gigiena Truda i Professional'nye Zabolevaniya. Labor Hygiene and Occupational Diseases. (V/O Mezhdunarodnaya Kniga, 113095 Moscow, USSR) V.1-36, 1957-1992. For publisher information, see MTPEEI Volume(issue)/page/year: 32(8),52,1988
TYPE OF TEST :
LD50 - Lethal dose, 50 percent kill
ROUTE OF EXPOSURE :
Administration onto the skin
SPECIES OBSERVED :
Rodent - rabbit
DOSE/DURATION :
>5 gm/kg
TOXIC EFFECTS :
Details of toxic effects not reported other than lethal dose value
REFERENCE :
FCTXAV Food and Cosmetics Toxicology. (London, UK) V.1-19, 1963-81. For publisher information, see FCTOD7. Volume(issue)/page/year: 13,859,1975 *** NIOSH STANDARDS DEVELOPMENT AND SURVEILLANCE DATA *** NIOSH OCCUPATIONAL EXPOSURE SURVEY DATA : NOES - National Occupational Exposure Survey (1983) NOES Hazard Code - T1525 No. of Facilities: 3192 (estimated) No. of Industries: 24 No. of Occupations: 19 No. of Employees: 27570 (estimated) No. of Female Employees: 12744 (estimated)

Safety Information

[ Symbol ]:

GHS02

[ Signal Word ]:
Warning

[ Hazard Statements ]:
H226

[ Personal Protective Equipment ]:
Eyeshields;Gloves;half-mask respirator (US);multi-purpose combination respirator cartridge (US)

[ Hazard Codes ]:
F+

[ Risk Phrases ]:
R10

[ Safety Phrases ]:
S16

[ RIDADR ]:
UN 1224 3/PG 3

[ WGK Germany ]:
1

[ RTECS ]:
MJ9700000

[ Packaging Group ]:
III

[ Hazard Class ]:
3

[ HS Code ]:
2914190090

Synthetic Route

Precursor & DownStream

Precursor

  • Citral
  • sulcatol
  • 2-methyoxypropene
  • 3-(1-methoxy-1-methyl-ethoxy)-3-methyl-but-1-ene
  • 3,7-dimethyloct-6-en-1-yn-3-ol
  • 3-Methyl butynol
  • 2-Methyl-3-buten-2-ol
  • 2-methyl-2-(4-methylpent-3-enyl)-1,3-dioxolane
  • 2,2-Dimethoxypropane
  • 6-methyl-3-tosylhept-5-en-2-one

DownStream

  • 3,7-dimethyloct-6-en-1-yn-3-yl methyl carbonate
  • Heptaminol
  • tangerine acetate
  • 2-Heptanol, 6-methyl-
  • 2-Heptanone, 6-methyl-
  • sulcatol
  • GERANIC ACID
  • Geranylacetone
  • isometheptene
  • cis-Jasmone

Customs

[ HS Code ]: 2914190090

[ Summary ]:
2914190090 other acyclic ketones without other oxygen function。Supervision conditions:None。VAT:17.0%。Tax rebate rate:9.0%。MFN tariff:5.5%。General tariff:30.0%

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Related Compounds

  • 6-methylhept-5-en-2-one oxide
  • 6-Methylhept-5-en-2-one oxime
  • 3-allyl-6-methylhept-5-en-2-one
  • 1-chloro-6-methylhept-5-en-2-one
  • 7-ethoxy-6-methylhept-5-en-2-one
  • 7-hydroxy-6-methylhept-5-en-2-one
  • 4-((Cyclohexylamino)methyl)benzoic acid hydrochloride
  • 4-(3,5-Difluoro-4-methylphenyl)pyridine
  • 1-[(2,4-Dichlorophenyl)methyl]-N-(1,1-dimethylethyl)-2-methyl-1H-indole-3-methanamine
  • 2,2,2-Trifluoro-1-(4-methoxy-2-nitrophenyl)ethan-1-ol
  • 2-Methoxy-6-(pyrazol-1-yl)-benzonitrile
  • 1H-3-Benzazepin-7-ol, 8-chloro-2,3,4,5-tetrahydro-5-(3-iodophenyl)-3-methyl-, (S)-
  • (4-Methyl-tetrahydro-furan-2-yl)-methanol
  • N-(1-cyanocyclopentyl)-2-[4-(4-fluorobenzenesulfonyl)-1,4-diazepan-1-yl]acetamide
  • N-(3-Hydroxy-4-phenylbutan-2-yl)but-2-ynamide
  • 4,5,6,7-Tetrahydrobenzo[d]isoxazole-3-carbaldehyde