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N-(4-Amino-5-methoxy-2-methylphenyl)benzamide - 95%, high purity , CAS No.99-21-8
Discover N-(4-Amino-5-methoxy-2-methylphenyl)benzamide by Aladdin Scientific in 95% for only $214.90. Available - in Ligands at Aladdin Scientific. Tags: .
Basic Description
Synonyms
4'-Amino-5'-methoxy-2'-methylbenzanilide | CCG-46388 | N-(4-Amino-5-methoxy-2-methylphenyl)benzamide # | AKOS015969281 | 6W37LKR3X8 | EINECS 202-740-1 | SCHEMBL131762 | Fast Violet B, Dye content 85 % | SR-01000636089-1 | DTXSID8059188 | Fast violet B | B
Specifications & Purity
≥95%
Shipped In
Normal
Taxonomic Classification
Kingdom
Organic compounds
Superclass
Benzenoids
Class
Benzene and substituted derivatives
Subclass
Anilides
Intermediate Tree Nodes
Aromatic anilides
Direct Parent
Benzanilides
Alternative Parents
Methoxyanilines Diaminotoluenes Benzamides Aminophenyl ethers Phenoxy compounds Methoxybenzenes Benzoyl derivatives Anisoles Alkyl aryl ethers Secondary carboxylic acid amides Amino acids and derivatives Primary amines Organopnictogen compounds Organic oxides Hydrocarbon derivatives
Molecular Framework
Aromatic homomonocyclic compounds
Substituents
Benzanilide - Benzamide - Benzoic acid or derivatives - Aminophenyl ether - Diaminotoluene - Methoxyaniline - Anisole - Phenoxy compound - Benzoyl - Phenol ether - Aniline or substituted anilines - Aminotoluene - Methoxybenzene - Toluene - Alkyl aryl ether - Secondary carboxylic acid amide - Amino acid or derivatives - Carboxamide group - Carboxylic acid derivative - Ether - Hydrocarbon derivative - Organonitrogen compound - Organooxygen compound - Primary amine - Organic nitrogen compound - Organic oxygen compound - Organopnictogen compound - Organic oxide - Amine - Aromatic homomonocyclic compound
Description
This compound belongs to the class of organic compounds known as benzanilides. These are aromatic compounds containing an anilide group in which the carboxamide group is substituted with a benzene ring. They have the general structure RNC(=O)R', where R,R'= benzene.
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
488183860
IUPAC Name
N-(4-amino-5-methoxy-2-methylphenyl)benzamide
INCHI
InChI=1S/C15H16N2O2/c1-10-8-12(16)14(19-2)9-13(10)17-15(18)11-6-4-3-5-7-11/h3-9H,16H2,1-2H3,(H,17,18)
InChIKey
VENDXQNWODZJGB-UHFFFAOYSA-N
Smiles
CC1=CC(=C(C=C1NC(=O)C2=CC=CC=C2)OC)N
Isomeric SMILES
CC1=CC(=C(C=C1NC(=O)C2=CC=CC=C2)OC)N
Molecular Weight
256.3
Reaxy-Rn
3357591
Reaxys-RN_link_address
https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=3357591&ln=
Certificates（CoA,COO,BSE/TSE and Analysis Chart)
Chemical and Physical Properties
Molecular Weight
256.300 g/mol
XLogP3
2.400
Hydrogen Bond Donor Count
2
Hydrogen Bond Acceptor Count
3
Rotatable Bond Count
3
Exact Mass
256.121 Da
Monoisotopic Mass
256.121 Da
Topological Polar Surface Area
64.400 Ų
Heavy Atom Count
19
Formal Charge
0
Complexity
303.000
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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J2029102