2-Methyl-3-[(2E)-3,7,11,15-tetramethyl-2-hexadecen-1-yl]-1,4-naphthoquinone | CAS No. 12001-79-5

2-Methyl-3-[(2E)-3,7,11,15-tetramethyl-2-hexadecen-1-yl]-1,4-naphthoquinone

Basic Information

CAS Number

12001-79-5

Molecular Formula

C31H46O2

Molecular Weight

450.71 g/mol

AD

Basic Physical Properties

Melting Point

−20 °C

Flash Point

>230 °F

Refractive Index

n20/D 1.527(lit.)

CC1=C(C(=O)C2=CC=CC=C2C1=O)CC=C(C)CCCC(C)CCCC(C)CCCC(C)C

InChI

InChI=1S/C31H46O2/c1-22(2)12-9-13-23(3)14-10-15-24(4)16-11-17-25(5)20-21-27-26(6)30(32)28-18-7-8-19-29(28)31(27)33/h7-8,18-20,22-24H,9-17,21H2,1-6H3/b25-20+

InChIKey

MBWXNTAXLNYFJB-LKUDQCMESA-N

LogP

9.1576

Topological Polar Surface Area

34.14 Ų

Hydrogen Bond Donor/Acceptor

0 / 2

Complexity

696

Synonyms & References

English

  • VitaminK1-18O(Mixtureof1-18Oand4-18O)
  • 2-Methyl-3-(3,7,11,15-tetramethylhexadec-2-enyl)-1,4-naphthoquinone
  • [r-[r*,R*-(E)]]-2-Methyl-3-(3,7,11,15-tetramethyl-2-hexadecenyl)-1,4-napthalenedione
  • NCGC00186656-01
  • 2-(3,7,11,15-Tetramethylhexadec-2-enyl)-3-methylnaphthalene-1,4-dione
  • P0642
  • C02059
  • Vitamin K1 (TN)
  • 1,4-Naphthalenedione, 2-methyl-3-((2E,7R,11R)-3,7,11,15-tetramethyl-2-hexadecenyl)-, radical ion(1-)
  • 2581046-19-5
  • Vitamin K1 (Mixture of Trans Racemic & Cis Racemic) Mixture of eight isomers
  • 1, 2-methyl-3-(3,7,11,15-tetramethyl-2-hexadecenyl)-
  • [r-[r*,R*-(E)]]-2-Methyl-3-(3-7,11,15-tetramethyl-2-hexadecenyl)-1,4-naphthalenedione
  • 2-methyl-3-(3,7,11,15-tetramethylhexadec-2-en-1-yl)naphthalene-1,4-dione
  • 2-methyl-3-[(E)-3,7,11,15-tetramethylhexadec-2-enyl]naphthalene-1,4-dione
  • HMS2232C17
  • 2-Methyl-3-[(2E)-3,7,11,15-tetramethyl-2-hexadecenyl]naphthoquinone #
  • 10485-69-5
  • CHEBI:94399
  • Vitamin K semiquinone radical
  • .alpha.-Phylloquinone
  • starbld0012504
  • 27696-10-2
  • Phytonadione (JP17/USP)
  • 2-Methyl-3-(3,11,15-tetramethyl-2-hexadecenyl)-1,4-naphthalenedione
  • EINECS 234-408-7
  • Phytomenadione (INN)
  • (E)-2-Methyl-3-(3,7,11,15-tetramethylhexadec-2-en-1-yl)naphthalene-1,4-dione1
  • (E)-2-Methyl-3-(3,7,11,15-tetramethylhexadec-2-en-1-yl)naphthalene-1,4-dione
  • Vitamin K (generic)
  • EINECS 279-833-9

MDL Number

MFCD00001683

FAQ

What regulatory guidelines apply to 2-Methyl-3-[(2E)-3,7,11,15-tetramethyl-2-hexadecen-1-yl]-1,4-naphthoquinone (CAS: 12001-79-5)?

2-Methyl-3-[(2E)-3,7,11,15-tetramethyl-2-hexadecen-1-yl]-1,4-naphthoquinone (CAS: 12001-79-5) is regulated under the Globally Harmonized System of Classification and Labelling of Chemicals (GHS) for hazardous substances. In the European Union, it falls under the Registration, Evaluation, Authorisation and Restriction of Chemicals (REACH) regulation. In the United States, it is also subject to regulations by the Environmental Protection Agency (EPA) and the Food and Drug Administration (FDA) depending on its intended use.

Are there alternatives to 2-Methyl-3-[(2E)-3,7,11,15-tetramethyl-2-hexadecen-1-yl]-1,4-naphthoquinone (CAS: 12001-79-5) in synthesis?

For synthesis purposes, alternatives to 2-Methyl-3-[(2E)-3,7,11,15-tetramethyl-2-hexadecen-1-yl]-1,4-naphthoquinone (CAS: 12001-79-5) include other naphthoquinones that have similar functional groups. Common substitutes include 1,4-naphthoquinone itself and 2-Methyl-3-[(2Z)-3,7,11,15-tetramethyl-2-hexadecen-1-yl]-1,4-naphthoquinone. These alternatives may offer similar reactivity and can be used in place of the target compound depending on the specific application.

What is the market or research trend for 2-Methyl-3-[(2E)-3,7,11,15-tetramethyl-2-hexadecen-1-yl]-1,4-naphthoquinone (CAS: 12001-79-5)?

The market for 2-Methyl-3-[(2E)-3,7,11,15-tetramethyl-2-hexadecen-1-yl]-1,4-naphthoquinone (CAS: 12001-79-5) is currently driven by its use in specialized applications such as pharmaceuticals and organic synthesis. Research trends indicate a focus on developing new derivatives and exploring its potential in areas like catalysis and material science. Market demand is expected to grow as these applications are further explored and validated.

How should waste containing 2-Methyl-3-[(2E)-3,7,11,15-tetramethyl-2-hexadecen-1-yl]-1,4-naphthoquinone (CAS: 12001-79-5) be handled?

Waste containing 2-Methyl-3-[(2E)-3,7,11,15-tetramethyl-2-hexadecen-1-yl]-1,4-naphthoquinone (CAS: 12001-79-5) should be collected and stored in compliant containers to prevent spillage or contamination. For disposal, it is recommended to consult local waste management regulations. Typically, such waste is treated by incineration or professional waste disposal services. Environmental protection precautions include ensuring proper ventilation and personal protective equipment (PPE) during handling and disposal to mitigate health and environmental risks.

Related Compounds

You might also like

Compound Q&A

What is 6-Methyl-7-oxabicyclo[4.1.0]heptan-2-one (CAS: 21889-89-4)?

6-Methyl-7-oxabicyclo[4.1.0]heptan-2-one is a cyclic ketone with a molecular for...

21889-89-46-Methyl-7-oxabicycl...
Compound Q&A

What is 4-[(6-Methyl-2-pyrazinyl)oxy]benzoic acid (CAS: 906353-00-2)?

4-[(6-Methyl-2-pyrazinyl)oxy]benzoic acid is a chemical compound with the CAS nu...

906353-00-24-[(6-Methyl-2-pyraz...
Compound Q&A

What is 2-(2-Pyridinyl)-1,3-propanediol (CAS: 49745-42-8)?

2-(2-Pyridinyl)-1,3-propanediol (CAS: 49745-42-8) is a colorless to slightly yel...

49745-42-82-(2-Pyridinyl)-1,3-...
Compound Q&A

What is 2-(6-Chloro-2-pyridinyl)-2-phenylacetonitrile (CAS: 24783-42-4)?

2-(6-Chloro-2-pyridinyl)-2-phenylacetonitrile is an organic compound with the CA...

24783-42-42-(6-Chloro-2-pyridi...
Compound Q&A

What is 2-Oxopropanamide (CAS: 631-66-3)?

2-Oxopropanamide, also known as 2-aminoacrylic acid, is a chemical compound with...

631-66-32-Oxopropanamide
Compound Q&A

What is 2-Methyl-2-propanyl 4-(5-bromo-6-methyl-2-pyridinyl)-1-piperazinecarboxylate (CAS: 1289040-88-5)?

2-Methyl-2-propanyl 4-(5-bromo-6-methyl-2-pyridinyl)-1-piperazinecarboxylate (CA...

1289040-88-52-Methyl-2-propanyl ...
Compound Q&A

What is NAMPT inhibitor-linker 1 (CAS: 2241019-57-6)?

NAMPT inhibitor-linker 1 (CAS: 2241019-57-6) is a chemical compound designed as ...

2241019-57-6NAMPT inhibitor-link...
Compound Q&A

What is (2-(2,2,2-Trifluoroacetyl)pyridin-4-yl)boronic acid (CAS: 1310404-58-0)?

It is a chemical compound with the structure (2-(2,2,2-Trifluoroacetyl)pyridin-4...

1310404-58-0(2-(2,2,2-Trifluoroa...
Compound Q&A

What is 1-(2-Chlorophenyl)-6-(3,3,3-trifluoro-2-methylpropyl)-1,5-dihydro-4H-pyrazolo[3,4-d]pyrimidin-4-one (CAS: 794568-90-4)?

1-(2-Chlorophenyl)-6-(3,3,3-trifluoro-2-methylpropyl)-1,5-dihydro-4H-pyrazolo[3,...

794568-90-41-(2-Chlorophenyl)-6...
Compound Q&A

What is Vinyl(chloromethyl)dimethoxysilane (CAS: 1314981-48-0)?

Vinyl(chloromethyl)dimethoxysilane is an organosilicon compound with the molecul...

1314981-48-0Vinyl(chloromethyl)d...