3-Aminophenol - analytical standard, ≥99% , CAS No.591-27-5

CAS: 591-27-5 Cat. No.: A108482 Formula: C₆H₇NO Peso molecolare: 109.13 Beilstein Registry Number: 636059 Numero EC: 209-711-2

QUALITÀ & PUREZZA Analytical standard, ≥99%

Synonyms

RODOL EG|3-AMINOPHENOL [HSDB]|MESALAZINE IMPURITY B [EP IMPURITY]|PHENOL,3-AMINO|COVASTYLE MAP|Fourrine EG|Tertral EG|3-hydroxybenzenamine|C.I. Oxidation Base 7|m-Aminofenol [Czech]|ORISTAR APH3|Pelagol EG|Phenol, m-amino-|m-Aminophenol [UN2512] [Poison]|BASF ursol EG|COLOREX MAP|m-aminophenol (M6)|Nako TEG|M-AMINOPHENOL|m-amino-phenol|3-Hydroxyaniline|3-hydroxy-aniline|3-Amino-1-hydroxybenzene|JAROCOL MAP|m-Hydroxyaniline|1-Amino-3-hydroxybenzene|Zoba EG|m-Aminofenol|phenmedipham TP2|Phenol, 3-amino-|Ursol EG|CI Oxidation Base 7|Furro EG|M-AMINOPHENOL [INCI]|Fourrine 65|Futramine EG|M-AMINOPHENOL [MI]|M-AMINOPHENOL [USP-RS]|Renal EG|3-Aminophenol|3-amino-phenol|3-azaniumylphenolate|Mesalazine Imp. B (EP); m-Aminophenol; 3-Aminophenol; Mesalazine Impurity B|3-amino phenol|Fouramine EG|UN 2512 (Salt/Mix)

Storage

Protected from light,Room temperature

Shipped In

FedEx DG Service

Specifiche

Sinonimi

RODOL EG | 3-AMINOPHENOL [HSDB] | MESALAZINE IMPURITY B [EP IMPURITY] | PHENOL,3-AMINO | COVASTYLE MAP | Fourrine EG | Tertral EG | 3-hydroxybenzenamine | C.I. Oxidation Base 7 | m-Aminofenol [Czech] | ORISTAR APH3 | Pelagol EG | Phenol, m-amino- | m-Aminophenol [UN2512] [Poison] | BASF ursol EG | COLOREX MAP | m-aminophenol (M6) | Nako Mostra altro

Specifiche e purezza

analytical standard, ≥99%

Condizioni di conservazione di stoccaggio

Protected from light,Room temperature

Spedito in

FedEx DG Service

Grado

Standard analitico

Purezza

≥99%

Nomi e identificatori

Pubchem Sid

508808882

Sorrisi canonici

C1=CC(=CC(=C1)O)N

IUPAC Name

3-aminophenol

InChIKey

CWLKGDAVCFYWJK-UHFFFAOYSA-N

INCHI

1S/C6H7NO/c7-5-2-1-3-6(8)4-5/h1-4,8H,7H2

Isomeri SMILES

C1=CC(=CC(=C1)O)N

WGK Germania

2

RTECS

SJ4900000

Numero UN

2512

Gruppo di imballaggio

III

Peso molecolare

109.13

Beilstein

636059

Reaxy-Rn

636059

Reaxys-RN_link_address

https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=636059&ln=

Taxonomic Classification

Taxonomy Tree

• Kingdom Organic compounds
  • Superclass Benzenoids
    • Classe Benzene and substituted derivatives
      • Subclass Aniline and substituted anilines

• Kingdom: Organic compounds
• Superclass: Benzenoids
• Classe: Benzene and substituted derivatives
• Subclass: Aniline and substituted anilines
• Intermediate Tree Nodes: Not available
• Direct Parent: Aniline and substituted anilines
• Alternative Parents: m-Aminophenols 1-hydroxy-4-unsubstituted benzenoids 1-hydroxy-2-unsubstituted benzenoids Primary amines Organopnictogen compounds Organooxygen compounds Hydrocarbon derivatives
• Molecular Framework: Aromatic homomonocyclic compounds
• Substituents: M-aminophenol - Aniline or substituted anilines - Aminophenol - 1-hydroxy-4-unsubstituted benzenoid - 1-hydroxy-2-unsubstituted benzenoid - Phenol - Organic nitrogen compound - Organic oxygen compound - Organopnictogen compound - Hydrocarbon derivative - Primary amine - Organooxygen compound - Organonitrogen compound - Amine - Aromatic homomonocyclic compound
• Descrizione: This compound belongs to the class of organic compounds known as aniline and substituted anilines. These are organic compounds containing an aminobenzene moiety.
• External Descriptors: aminophenol

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.

DOI: 10.1186/s13321-016-0174-y

Obiettivi associati (umani)

CA2 Tclin Carbonic anhydrase II (17698 Activities)

Discover Target: CA2

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CA1 Tclin Carbonic anhydrase I (13240 Activities)

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CA14 Tclin Carbonic anhydrase XIV (1305 Activities)

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ALDH1A1 Tchem Aldehyde dehydrogenase 1A1 (77053 Activities)

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NR1H4 Tclin Bile acid receptor FXR (6228 Activities)

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CA12 Tclin Carbonic anhydrase XII (6231 Activities)

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CA9 Tclin Carbonic anhydrase IX (8255 Activities)

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TDP1 Tchem Tyrosyl-DNA phosphodiesterase 1 (345557 Activities)

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GMNN Tbio Geminin (128009 Activities)

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USP1 Tchem Ubiquitin carboxyl-terminal hydrolase 1 (22556 Activities)

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RUNX1 Tbio Runt-related transcription factor 1/Core-binding factor subunit beta (7867 Activities)

Discover Target: RUNX1

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Obiettivi associati (non umani)

Ca7 Carbonic anhydrase VII (3 Activities)

Discover Target: Ca7

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Bacillus subtilis (32866 Activities)

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Poliovirus 1 (1274 Activities)

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L1210 (27553 Activities)

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Txnrd1 Thioredoxin reductase 1, cytoplasmic (45279 Activities)

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TGR Thioredoxin glutathione reductase (28579 Activities)

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Rorc Nuclear receptor ROR-gamma (89407 Activities)

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Meccanismi d'azione

Proprietà chimiche e fisiche

• Solubilità: Slightly soluble in water, soluble in alcohol and ether.
• Sensibilità: Light sensitive.
• Punto di infiammabilità (°C): 155℃
• Punto di ebollizione (°C): 164 °C/11 mmHg
• Punto di fusione (°C): 123℃
• Peso molecolare: 109.130 g/mol
• XLogP3: 0.200
• Hydrogen Bond Donor Count: 2
• Hydrogen Bond Acceptor Count: 2
• Rotatable Bond Count: 0
• Exact Mass: 109.053 Da
• Monoisotopic Mass: 109.053 Da
• Topological Polar Surface Area: 46.300 Ų
• Heavy Atom Count: 8
• Formal Charge: 0
• Complexity: 74.900
• 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