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Tetrahydrofuran-3-carboxaldehyde solution - 50wt. % in H₂O, 98%, high purity , CAS No.79710-86-4

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Tetrahydrofuran-3-carboxaldehyde solution - 50wt. % in H₂O, 98%, high purity , CAS No.79710-86-4

COA

Grade & Purity:

≥98%
50wt. % in H₂O

Cas Number: 79710-86-4
Molecular Weight: 100.12
MDL number: MFCD02101976
PubChem CID: 157568

In stock

Item Number

T466705

Grouped product items
SKU	Size	Availability	Price
T466705-25ml	25ml	Available within 8-12 weeks(?) Production requires sourcing of materials. We appreciate your patience and understanding.	$257.90
T466705-100ml	100ml	Available within 8-12 weeks(?) Production requires sourcing of materials. We appreciate your patience and understanding.	$884.90
T466705-500ml	500ml	Available within 8-12 weeks(?) Production requires sourcing of materials. We appreciate your patience and understanding.	$2,020.90

Basic Description

Synonyms	C02734 \| tetrahydro-3-furancarboxaldehyde \| AKOS000121109 \| SCHEMBL67754 \| (oxolan-3-yl)formaldehyde \| Tetrahydrofuran-3-carbaldehyde, 50% in water \| SY046752 \| TETRAHYDROFURAN-3-CARBOXALDEHYDE \| FT-0653338 \| tetrahydrofuran-3-carboxyaldehyde \| AMY5966 \|
Specifications & Purity	≥98%, 50wt. % in H₂O
Storage Temp	Store at 2-8°C
Shipped In	Wet ice This product requires cold chain shipping. Ground and other economy services are not available.
Product Description	The product is a 50 wt.% solution of tetrahydrofuran-3-carboxaldehyde in water.

Taxonomic Classification

Taxonomy Tree

Kingdom Organic compounds
- Superclass Organoheterocyclic compounds
  - Class Tetrahydrofurans

Kingdom	Organic compounds
Superclass	Organoheterocyclic compounds
Class	Tetrahydrofurans
Subclass	Not available
Intermediate Tree Nodes	Not available
Direct Parent	Tetrahydrofurans
Alternative Parents	Oxacyclic compounds Dialkyl ethers Organic oxides Hydrocarbon derivatives Aldehydes
Molecular Framework	Aliphatic heteromonocyclic compounds
Substituents	Tetrahydrofuran - Oxacycle - Ether - Dialkyl ether - Organic oxygen compound - Organic oxide - Hydrocarbon derivative - Organooxygen compound - Carbonyl group - Aldehyde - Aliphatic heteromonocyclic compound
Description	This compound belongs to the class of organic compounds known as tetrahydrofurans. These are heterocyclic compounds containing a saturated, aliphatic, five-membered ring where a carbon is replaced by an oxygen.
External Descriptors	Not available
1. Djoumbou Feunang Y, Eisner R, Knox C, Chepelev L, Hastings J, Owen G, Fahy E, Steinbeck C, Subramanian S, Bolton E, Greiner R, and Wishart DS. ClassyFire: Automated Chemical Classification With A Comprehensive, Computable Taxonomy. Journal of Cheminformatics, 2016, 8:61. DOI: 10.1186/s13321-016-0174-y

Associated Targets(Human)

TYR Tclin Tyrosinase (717 Activities)

Discover Target: TYR

Activity Type	Relation	Activity value	Units	Action Type	Journal	PubMed Id	doi	Assay Aladdin ID

AOX1 Tchem Aldehyde oxidase (429 Activities)

Discover Target: AOX1

Activity Type	Relation	Activity value	Units	Action Type	Journal	PubMed Id	doi	Assay Aladdin ID

Associated Targets(non-human)

Zea mays (820 Activities)

Explore this target

Activity Type	Relation	Activity value	Units	Action Type	Journal	PubMed Id	doi	Assay Aladdin ID

Gossypium hirsutum (233 Activities)

Explore this target

Activity Type	Relation	Activity value	Units	Action Type	Journal	PubMed Id	doi	Assay Aladdin ID

Mechanisms of Action

Mechanism of Action	Action Type	target ID	Target Name	Target Type	Target Organism	Binding Site Name	References

Names and Identifiers

IUPAC Name	oxolane-3-carbaldehyde
INCHI	InChI=1S/C5H8O2/c6-3-5-1-2-7-4-5/h3,5H,1-2,4H2
InChIKey	GSUBXIVOZXWGKF-UHFFFAOYSA-N
Smiles	C1COCC1C=O
Isomeric SMILES	C1COCC1C=O
PubChem CID	157568
Molecular Weight	100.12

Certificates（CoA,COO,BSE/TSE and Analysis Chart)

C of A & Other Certificates(BSE/TSE, COO):

Analytical Chart:

Chemical and Physical Properties

Flash Point(°C)	53.8℃
Boil Point(°C)	155.4℃at 760 mmHg
Molecular Weight	100.120 g/mol
XLogP3	-0.300
Hydrogen Bond Donor Count	0
Hydrogen Bond Acceptor Count	2
Rotatable Bond Count	1
Exact Mass	100.052 Da
Monoisotopic Mass	100.052 Da
Topological Polar Surface Area	26.300 Å²
Heavy Atom Count	7
Formal Charge	0
Complexity	70.500
Isotope Atom Count	0
Defined Atom Stereocenter Count	0
Undefined Atom Stereocenter Count	1
Defined Bond Stereocenter Count	0
Undefined Bond Stereocenter Count	0
The total count of all stereochemical bonds	0
Covalently-Bonded Unit Count	1

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