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γ-(2-Naphthyl)-γ-butyrolactone - 95%, high purity , CAS No.180037-65-4
Basic Description
Synonyms
SR-01000408138 | J-011494 | SR-01000408138-1 | gamma-(2-Naphthyl)-gamma-butyrolactone, 99% | gamma-(2-Naphthyl)-gamma-butyrolactone | gamma -(2-Naphthyl)- gamma -butyrolactone | EU-0069065 | 5-naphthalen-2-yloxolan-2-one | SMR001559857 | HMS3094K03 | AKOS
Specifications & Purity
≥95%
Storage Temp
Room temperature
Shipped In
Normal
Product Description
Product Describtion:
γ-(2-Naphthyl)-γ-butyrolactone is a lactone.
Taxonomic Classification
Kingdom
Organic compounds
Superclass
Benzenoids
Class
Naphthalenes
Subclass
Not available
Intermediate Tree Nodes
Not available
Direct Parent
Naphthalenes
Alternative Parents
Gamma butyrolactones Tetrahydrofurans Carboxylic acid esters Oxacyclic compounds Monocarboxylic acids and derivatives Organic oxides Hydrocarbon derivatives Carbonyl compounds
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Naphthalene - Gamma butyrolactone - Tetrahydrofuran - Lactone - Carboxylic acid ester - Oxacycle - Organoheterocyclic compound - Monocarboxylic acid or derivatives - Carboxylic acid derivative - Organic oxygen compound - Organic oxide - Hydrocarbon derivative - Organooxygen compound - Carbonyl group - Aromatic heteropolycyclic compound
Description
This compound belongs to the class of organic compounds known as naphthalenes. These are compounds containing a naphthalene moiety, which consists of two fused benzene rings.
External Descriptors
Not available
Data sources
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.
Associated Targets(Human)
Mechanisms of Action
Mechanism of Action
Action Type
target ID
Target Name
Target Type
Target Organism
Binding Site Name
References
Names and Identifiers
Pubchem Sid
488189038
Pubchem Sid Url
https://pubchem.ncbi.nlm.nih.gov/substance/488189038
IUPAC Name
5-naphthalen-2-yloxolan-2-one
INCHI
InChI=1S/C14H12O2/c15-14-8-7-13(16-14)12-6-5-10-3-1-2-4-11(10)9-12/h1-6,9,13H,7-8H2
InChIKey
RTHDLBGPIRDCFJ-UHFFFAOYSA-N
Smiles
C1CC(=O)OC1C2=CC3=CC=CC=C3C=C2
Isomeric SMILES
C1CC(=O)OC1C2=CC3=CC=CC=C3C=C2
WGK Germany
3
Molecular Weight
212.24
Reaxy-Rn
168796
Reaxys-RN_link_address
https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=168796&ln=
Certificates（CoA,COO,BSE/TSE and Analysis Chart)
Chemical and Physical Properties
Melt Point(°C)
119-121 °C
Molecular Weight
212.240 g/mol
XLogP3
3.000
Hydrogen Bond Donor Count
0
Hydrogen Bond Acceptor Count
2
Rotatable Bond Count
1
Exact Mass
212.084 Da
Monoisotopic Mass
212.084 Da
Topological Polar Surface Area
26.300 Ų
Heavy Atom Count
16
Formal Charge
0
Complexity
274.000
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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D2313201