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(3-Fluorophenyl)(4-methoxyphenyl)methanol - 98%, high purity , CAS No.38158-78-0
Discover (3-Fluorophenyl)(4-methoxyphenyl)methanol by Aladdin Scientific in 98% for only $2,195.90. Available - in Ligands at Aladdin Scientific. Tags: .
Basic Description
Synonyms
(3-Fluorophenyl)(4-methoxyphenyl)methanol | 38158-78-0 | 3-Fluoro-4'-methoxybenzhydrol | (3-fluorophenyl)-(4-methoxyphenyl)methanol | DTXSID50374586 | AKOS003583334 | AKOS016842840 | BS-28368
Specifications & Purity
≥98%
Storage Temp
Room temperature
Shipped In
Normal
Taxonomic Classification
Kingdom
Organic compounds
Superclass
Benzenoids
Class
Benzene and substituted derivatives
Subclass
Diphenylmethanes
Intermediate Tree Nodes
Not available
Direct Parent
Diphenylmethanes
Alternative Parents
Phenoxy compounds Methoxybenzenes Anisoles Fluorobenzenes Alkyl aryl ethers Aryl fluorides Secondary alcohols Organofluorides Hydrocarbon derivatives Aromatic alcohols
Molecular Framework
Aromatic homomonocyclic compounds
Substituents
Diphenylmethane - Phenoxy compound - Anisole - Methoxybenzene - Phenol ether - Alkyl aryl ether - Halobenzene - Fluorobenzene - Aryl fluoride - Aryl halide - Secondary alcohol - Ether - Alcohol - Organohalogen compound - Organofluoride - Organooxygen compound - Aromatic alcohol - Hydrocarbon derivative - Organic oxygen compound - Aromatic homomonocyclic compound
Description
This compound belongs to the class of organic compounds known as diphenylmethanes. These are compounds containing a diphenylmethane moiety, which consists of a methane wherein two hydrogen atoms are replaced by two phenyl groups.
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
IUPAC Name
(3-fluorophenyl)-(4-methoxyphenyl)methanol
INCHI
InChI=1S/C14H13FO2/c1-17-13-7-5-10(6-8-13)14(16)11-3-2-4-12(15)9-11/h2-9,14,16H,1H3
InChIKey
HDWVVRSGQJYZPH-UHFFFAOYSA-N
Smiles
COC1=CC=C(C=C1)C(C2=CC(=CC=C2)F)O
Isomeric SMILES
COC1=CC=C(C=C1)C(C2=CC(=CC=C2)F)O
Molecular Weight
232.3
Reaxy-Rn
2458990
Reaxys-RN_link_address
https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=2458990&ln=
Certificates（CoA,COO,BSE/TSE and Analysis Chart)
Chemical and Physical Properties
Molecular Weight
232.250 g/mol
XLogP3
2.800
Hydrogen Bond Donor Count
1
Hydrogen Bond Acceptor Count
3
Rotatable Bond Count
3
Exact Mass
232.09 Da
Monoisotopic Mass
232.09 Da
Topological Polar Surface Area
29.500 Ų
Heavy Atom Count
17
Formal Charge
0
Complexity
226.000
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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