N-Phenylurea - ≥97% , CAS No.64-10-8

CAS: 64-10-8 Cat. No.: P105589 Peso molecular: 136.15 Beilstein Registry Number: 1934615 Número EC: 200-576-5

GRADE & PURITY ≥97%

Synonyms

MFCD00007944 | UNII-862I85399W | FT-0601827 | PHENYLUREA | Phenyl-urea | SCHEMBL54471 | Urea, N-phenyl | Urea, N-phenyl- | Carbamimidic acid, phenyl- (9CI) | KSC-294-042 | N-Phenylurea | Tox21_301449 | C11241 | N-phenylcarbamimidicacid | N-PHENYLUREA [MI]

Storage

Store at 2-8°C

Shipped In

Wet ice

Specifications

Sinónimos

MFCD00007944 | UNII-862I85399W | FT-0601827 | PHENYLUREA | Phenyl-urea | SCHEMBL54471 | Urea, N-phenyl | Urea, N-phenyl- | Carbamimidic acid, phenyl- (9CI) | KSC-294-042 | N-Phenylurea | Tox21_301449 | C11241 | N-phenylcarbamimidicacid | N-PHENYLUREA [MI]

Especificaciones y pureza

≥97%

Condiciones de almacenamiento de almacenamiento

Store at 2-8°C

Enviado en

Wet ice

Este producto requiere envío en cadena de frío. Los servicios terrestres y otros servicios económicos no están disponibles.

Pureza

≥97%

Nombres e identificadores

• Pubchem Sid: 504751012
• Pubchem Sid Url: https://pubchem.ncbi.nlm.nih.gov/substance/504751012
• Sonrisas canónicas: C1=CC=C(C=C1)NC(=O)N
• IUPAC Name: phenylurea
• InChIKey: LUBJCRLGQSPQNN-UHFFFAOYSA-N
• INCHI: 1S/C7H8N2O/c8-7(10)9-6-4-2-1-3-5-6/h1-5H,(H3,8,9,10)
• Isómeros SMILES: C1=CC=C(C=C1)NC(=O)N
• WGK Alemania: 3
• RTECS: YU0650000
• Número ONU: 3002
• Grupo de embalaje: I
• Peso molecular: 136.15
• Beilstein: 1934615
• Reaxy-Rn: 1934615
• Reaxys-RN_link_address: https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=1934615&ln=

Taxonomic Classification

Taxonomy Tree

• Kingdom Organic compounds
  • Superclass Benzenoids
    • Clase Benzene and substituted derivatives
      • Subclass N-phenylureas

• Kingdom: Organic compounds
• Superclass: Benzenoids
• Clase: Benzene and substituted derivatives
• Subclass: N-phenylureas
• Intermediate Tree Nodes: Not available
• Direct Parent: N-phenylureas
• Alternative Parents: Ureas Organopnictogen compounds Organonitrogen compounds Organic oxides Hydrocarbon derivatives Carbonyl compounds
• Molecular Framework: Aromatic homomonocyclic compounds
• Substituents: N-phenylurea - Urea - Carbonic acid derivative - Organic nitrogen compound - Organic oxygen compound - Organopnictogen compound - Organic oxide - Hydrocarbon derivative - Organooxygen compound - Organonitrogen compound - Carbonyl group - Aromatic homomonocyclic compound
• Descripción: This compound belongs to the class of organic compounds known as n-phenylureas. These are compounds containing a N-phenylurea moiety, which is structurally characterized by a phenyl group linked to one nitrogen atom of a urea 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.

DOI: 10.1186/s13321-016-0174-y

Objetivos asociados (humanos)

TYR Tclin Tyrosinase (717 Activities)

Discover Target: TYR

Activity Type	Relation	Activity value	Units	Action Type	Journal	PubMed Id	doi	Assay Aladdin ID

Objetivos asociados (no humanos)

Rattus norvegicus (775804 Activities)

Explore this target

Activity Type	Relation	Activity value	Units	Action Type	Journal	PubMed Id	doi	Assay Aladdin ID

Mecanismos de acción

Propiedades químicas y físicas

• Solubilidad: Soluble in water.
• Sensibilidad: Heat sensitive
• Punto de ebullición (°C): 238°C
• Punto de fusión (°C): 147°C
• Peso molecular: 136.150 g/mol
• XLogP3: 0.800
• Hydrogen Bond Donor Count: 2
• Hydrogen Bond Acceptor Count: 1
• Rotatable Bond Count: 1
• Exact Mass: 136.064 Da
• Monoisotopic Mass: 136.064 Da
• Topological Polar Surface Area: 55.100 Ų
• Heavy Atom Count: 10
• Formal Charge: 0
• Complexity: 119.000
• 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

Referencias

1. Si Chen, Xiaopeng Xu, Jiahuan Zhang, Wei Tang, Yingjun Qu, Xu Wang.  (2014)  Efficiency and mechanism for the stabilizing action of N,N'-bis(phenylcarbamoyl)alkyldiamines as thermal stabilizers and co-stabilizers for poly(vinyl chloride).  POLYMER DEGRADATION AND STABILITY,      [PMID:] [10.1016/j.polymdegradstab.2014.04.003]