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1-Cyclohexene-1-carboxaldehyde - 97%, high purity , CAS No.1192-88-7
Basic Description
Synonyms
1-cyclohexenecarbaldehyde | Cyclohex-1-enecarbaldehyde | DTXSID60409257 | AMY18835 | 1-Cyclohexene-1-carboxaldehyde | OANSOJSBHVENEI-UHFFFAOYSA-N | cyclohex-1-ene-1-carbaldehyde | Cyclohexenecarbaldehyde | 1-cyclohexene-1-carboaldehyde | EN300-98672 | AKO
Specifications & Purity
≥97%
Storage Temp
Store at -20°C,Argon charged
Shipped In
Ice chest + Ice pads
This product requires cold chain shipping. Ground and other economy services are not available.
Taxonomic Classification
Kingdom
Organic compounds
Superclass
Organic oxygen compounds
Class
Organic oxides
Subclass
Not available
Intermediate Tree Nodes
Not available
Direct Parent
Organic oxides
Alternative Parents
Hydrocarbon derivatives Aldehydes
Molecular Framework
Aliphatic homomonocyclic compounds
Substituents
Organic oxide - Hydrocarbon derivative - Organooxygen compound - Carbonyl group - Aldehyde - Aliphatic homomonocyclic compound
Description
This compound belongs to the class of organic compounds known as organic oxides. These are organic compounds containing an oxide group.
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.
Names and Identifiers
Pubchem Sid
488195139
Pubchem Sid Url
https://pubchem.ncbi.nlm.nih.gov/substance/488195139
IUPAC Name
cyclohexene-1-carbaldehyde
INCHI
InChI=1S/C7H10O/c8-6-7-4-2-1-3-5-7/h4,6H,1-3,5H2
InChIKey
OANSOJSBHVENEI-UHFFFAOYSA-N
Smiles
C1CCC(=CC1)C=O
Isomeric SMILES
C1CCC(=CC1)C=O
WGK Germany
3
Molecular Weight
110.15
Reaxy-Rn
1816746
Reaxys-RN_link_address
https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=1816746&ln=
Certificates（CoA,COO,BSE/TSE and Analysis Chart)
Chemical and Physical Properties
Sensitivity
Air sensitive
Flash Point(°F)
149 °F
Flash Point(°C)
65 °C
Boil Point(°C)
61 °C/10 mmHg (lit.)
Molecular Weight
110.150 g/mol
XLogP3
1.600
Hydrogen Bond Donor Count
0
Hydrogen Bond Acceptor Count
1
Rotatable Bond Count
1
Exact Mass
110.073 Da
Monoisotopic Mass
110.073 Da
Topological Polar Surface Area
17.100 Ų
Heavy Atom Count
8
Formal Charge
0
Complexity
114.000
Isotope Atom Count
0
Defined Atom Stereocenter Count
0
Undefined Atom Stereocenter Count
0
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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L2418655