5,6,7-trimethoxycoumarin, 55085-47-7

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CODE141788 CODE141788
Product(s):
55085-47-7 5,6,7-Trimethoxycoumarin 96%
5,6,7-Trimethoxycoumarin is a coumarin isolated from Artemisia apiacea. It can

Name:	5,6,7-trimethoxychromen-2-one
CAS Number:	55085-47-7	3D/inchi
FDA UNII:	Search
Nikkaji Web:	J672.787E
XlogP3-AA:	1.80 (est)
Molecular Weight:	236.22364000
Formula:	C12 H12 O5
NMR Predictor:	Predict (works with chrome, Edge or firefox)

Category:natural substances and extractives

US / EU / FDA / JECFA / FEMA / FLAVIS / Scholar / Patent Information:

Google Scholar:	Search
Google Books:	Search
Google Scholar: with word "volatile"	Search
Google Scholar: with word "flavor"	Search
Google Scholar: with word "odor"	Search
Google Patents:	Search
US Patents:	Search
EU Patents:	Search
Pubchem Patents:	Search
PubMed:	Search
NCBI:	Search

Physical Properties:

Assay:	95.00 to 100.00
Food Chemicals Codex Listed:	No
Boiling Point:	405.00 to 406.00 °C. @ 760.00 mm Hg (est)
Flash Point:	362.00 °F. TCC ( 183.30 °C. ) (est)
logP (o/w):	0.917 (est)
Soluble in:
	alcohol
	water, 3761 mg/L @ 25 °C (est)
Insoluble in:
	water

Organoleptic Properties:

Odor and/or flavor descriptions from others (if found).

Cosmetic Information:

None found

Suppliers:

BOC Sciences

For experimental / research use only.

5,6,7-Trimethoxycoumarin 96%

Odor: characteristic

Use: 5,6,7-Trimethoxycoumarin is a coumarin isolated from Artemisia apiacea. It can

Safety Information:


Hazards identification

Classification of the substance or mixture
GHS Classification in accordance with 29 CFR 1910 (OSHA HCS)
None found.
GHS Label elements, including precautionary statements

Pictogram

Hazard statement(s)
None found.
Precautionary statement(s)
None found.
Oral/Parenteral Toxicity:
Not determined
Dermal Toxicity:
Not determined
Inhalation Toxicity:
Not determined

Safety in Use Information:

Category:
natural substances and extractives
Recommendation for 5,6,7-trimethoxycoumarin usage levels up to:
	not for fragrance use.

Recommendation for 5,6,7-trimethoxycoumarin flavor usage levels up to:
	not for flavor use.

Safety References:

EPI System: View

AIDS Citations:Search

Cancer Citations:Search

Toxicology Citations:Search

EPA ACToR:Toxicology Data

EPA Substance Registry Services (SRS):Registry

Laboratory Chemical Safety Summary :148724

National Institute of Allergy and Infectious Diseases:Data

5,6,7-trimethoxychromen-2-one

Chemidplus:0055085477

References:

	5,6,7-trimethoxychromen-2-one
NIST Chemistry WebBook:	Search Inchi
Pubchem (cid):	148724
Pubchem (sid):	135105797

Other Information:

(IUPAC):	Atomic Weights of the Elements 2011 (pdf)
Videos:	The Periodic Table of Videos
tgsc:	Atomic Weights use for this web site
(IUPAC):	Periodic Table of the Elements
CHEBI:	View
CHEMBL:	View
KEGG (GenomeNet):	C09313
HMDB (The Human Metabolome Database):	Search
VCF-Online:	VCF Volatile Compounds in Food
ChemSpider:	View

Potential Blenders and core components note

None Found

Potential Uses:

None Found

Occurrence (nature, food, other):note

	artemisia apiacea Search Trop Picture
	geranium Search Trop Picture
	hibiscus Search Trop Picture

Synonyms:

	dimethylfraxetin
5,6,7-	trimethoxy-2H-1-benzopyran-2-one
6,7,8-	trimethoxy-2H-benzopyran-2-one
5,6,7-	trimethoxy-2H-chromen-2-one
5,6,7-	trimethoxychromen-2-one

Articles:

PubMed:Two new coumarin glycosides from Chimonanthus nitens.

PubMed:A new oxygenated ursane derivative from Canthium multiflorum.

PubMed:Artemisterol, a new steryl ester from the whole plant of Artemisia apiacea.

PubMed:Irritant and cytotoxic coumarins from Angelica glauca Edgew roots.

PubMed:Swarnalin and cis-swarnalin, two new tetrahydrofuran derivatives with free radical scavenging activity, from the aerial parts of Cuscuta reflexa.

PubMed:Fascinating metabolic pools of Pelargonium sidoides and Pelargonium reniforme, traditional and phytomedicinal sources of the herbal medicine Umckaloabo.

PubMed:Constituents from the non-polar fraction of Artemisia apiacea.

PubMed:A new phorbol diester from Aleurites moluccana.

PubMed:Antibacterial activity of extracts and constituents of Pelargonium sidoides and Pelargonium reniforme.

Notes:

None found

5,6,7-trimethoxycoumarin dimethylfraxetin

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Articles:

5,6,7-trimethoxycoumarin
dimethylfraxetin