1-Acetyl-2-phenylhydrazine - ≥98% , CAS No.114-83-0

CAS: 114-83-0 Cat. No.: A100226 Molecular Weight: 150.18 Beilstein Registry Number: 15(2)92 EC Number: 204-055-3

GRADE & PURITY ≥98%

Synonyms

1-Acetyl-2-phenylhydrazine, >=98% | HSDB 7235 | .beta.-Acetylphenylhydrazine | NSC 2064 | N-Acetoylphenylhydrazone | MFCD00008672 | STK400328 | APH | AS-12891 | N'-Phenylacethydrazide | AKOS000119811 | InChI=1/C8H10N2O/c1-7(11)9-10-8-5-3-2-4-6-8/h2-6,10H,

Storage

Argon charged,Room temperature

Shipped In

Normal

Specifications

Synonyms

1-Acetyl-2-phenylhydrazine, >=98% | HSDB 7235 | .beta.-Acetylphenylhydrazine | NSC 2064 | N-Acetoylphenylhydrazone | MFCD00008672 | STK400328 | APH | AS-12891 | N'-Phenylacethydrazide | AKOS000119811 | InChI=1/C8H10N2O/c1-7(11)9-10-8-5-3-2-4-6-8/h2-6, 10H,

Specifications & Purity

≥98%

Biochemical and Physiological Mechanisms

Vascular tumor initiator in experimental animal model.

Storage

Argon charged, Room temperature

Shipped In

Normal

Purity

≥98%

Names and Identifiers

• Pubchem Sid: 488180738
• Pubchem Sid Url: https://pubchem.ncbi.nlm.nih.gov/substance/488180738
• Canonical Smiles: CC(=O)NNC1=CC=CC=C1
• IUPAC Name: N'-phenylacetohydrazide
• InChIKey: UICBCXONCUFSOI-UHFFFAOYSA-N
• INCHI: 1S/C8H10N2O/c1-7(11)9-10-8-5-3-2-4-6-8/h2-6,10H,1H3,(H,9,11)
• Isomeric SMILES: CC(=O)NNC1=CC=CC=C1
• WGK Germany: 3
• RTECS: AJ2900000
• UN Number: 2811
• Packing Group: I
• Molecular Weight: 150.18
• Beilstein: 15(2)92
• Reaxy-Rn: 742880
• Reaxys-RN_link_address: https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=742880&ln=

Taxonomic Classification

Taxonomy Tree

• Kingdom Organic compounds
  • Superclass Benzenoids
    • Class Benzene and substituted derivatives
      • Subclass Phenylhydrazines

• Kingdom: Organic compounds
• Superclass: Benzenoids
• Class: Benzene and substituted derivatives
• Subclass: Phenylhydrazines
• Intermediate Tree Nodes: Not available
• Direct Parent: Phenylhydrazines
• Alternative Parents: Acetamides Carboxylic acid hydrazides Organopnictogen compounds Organonitrogen compounds Organic oxides Hydrocarbon derivatives Carbonyl compounds
• Molecular Framework: Aromatic homomonocyclic compounds
• Substituents: Phenylhydrazine - Acetamide - Carboxylic acid hydrazide - Carboxylic acid derivative - Organic nitrogen compound - Organic oxygen compound - Organopnictogen compound - Organic oxide - Hydrocarbon derivative - Organooxygen compound - Organonitrogen compound - Carbonyl group - Aromatic homomonocyclic compound
• Description: This compound belongs to the class of organic compounds known as phenylhydrazines. These are compounds containing a phenylhydrazide moiety, which consists of a hydrazide substituent attached to a phenyl 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

Associated Targets(Human)

NR3C1 Tclin Glucocorticoid receptor (14987 Activities)

Discover Target: NR3C1

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

ALOX5 Tclin Arachidonate 5-lipoxygenase (6568 Activities)

Discover Target: ALOX5

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

TSHR Tclin Thyroid stimulating hormone receptor (29986 Activities)

Discover Target: TSHR

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

PPARG Tclin Peroxisome proliferator-activated receptor gamma (15191 Activities)

Discover Target: PPARG

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

RXRA Tclin Retinoid X receptor alpha (3637 Activities)

Discover Target: RXRA

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

CXCL8 Tchem Interleukin-8 (642 Activities)

Discover Target: CXCL8

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

ALOX15B Tchem Arachidonate 15-lipoxygenase, type II (7244 Activities)

Discover Target: ALOX15B

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

CYP3A4 Tclin Cytochrome P450 3A4 (53859 Activities)

Discover Target: CYP3A4

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

Associated Targets(non-human)

Nfe2l2 Nuclear factor erythroid 2-related factor 2 (214 Activities)

Discover Target: Nfe2l2

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

Mechanisms of Action

Chemical and Physical Properties

• Solubility: Soluble in hot water and alcohol, slightly soluble in ether.
• Sensitivity: air sensitive
• Melt Point(°C): 128-132°C
• Molecular Weight: 150.180 g/mol
• XLogP3: 0.700
• Hydrogen Bond Donor Count: 2
• Hydrogen Bond Acceptor Count: 2
• Rotatable Bond Count: 2
• Exact Mass: 150.079 Da
• Monoisotopic Mass: 150.079 Da
• Topological Polar Surface Area: 41.100 Ų
• Heavy Atom Count: 11
• Formal Charge: 0
• Complexity: 130.000
• 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

References

1. Yanyan Qian, Li Wang, Zhiqiang Zhang, Xinxin Li, Chaofei Niu, Xiao Li, Erjuan Ning, Bingji Ma.  (2022)  Physical-chemical properties of heteropolysaccharides from different processed forms of Rehmanniae Radix.  PROCESS BIOCHEMISTRY,      [PMID:] [10.1016/j.procbio.2022.07.032]

2. Dongning Zhang, Bailu Duan, Li Sun, Yanfen Duan, Sili Zheng, Jingjing Li, Hailong Yin, Dandan Mu, Shuaihong Hou, Guoyan Mo, Lintao Han, Fang Huang, Qiang Yin.  (2022)  Mechanism of Shiliu Buxue Syrup for anemia using integrated metabolomics and network pharmacology.  ANALYTICAL BIOCHEMISTRY,      [PMID:35690102] [10.1016/j.ab.2022.114774]

3. Wang Yang-yang, Zhou Ning, Shan Zeng-fu, Ke Ying-ying, Liu Zhen, Liu Zhen-hui, Feng Wei-sheng, Zheng Xiao-ke.  (2022)  Metabolomic strategies and biochemical analysis of the effect of processed Rehmanniae radix extract on a blood-deficient rat model.  BMC Complementary Medicine and Therapies,  22  (1): (1-14).  [PMID:35337319] [10.1186/s12906-022-03560-x]

4. YueTao Liu, ZiYing Wang, XueMei Qin.  (2021)  Metabolomics and molecular docking to compare of the efficacies of wild-simulated and transplanted Astragali Radix based on its compatibility with Angelicae Sinensis Radix against blood deficiency.  JOURNAL OF CHROMATOGRAPHY B-ANALYTICAL TECHNOLOGIES IN THE BIOMEDICAL AND LIFE SCIENCES,      [PMID:33878534] [10.1016/j.jchromb.2021.122682]

5. YueTao Liu, XinQi Li, AiPing Li, Ke Li, XueMei Qin.  (2020)  UHPLC Q-Exactive MS-based spleen metabolomics and lipidomics to explore the effect mechanisms of Danggui Buxue Decoction in anemia mice.  JOURNAL OF PHARMACEUTICAL AND BIOMEDICAL ANALYSIS,      [PMID:32171146] [10.1016/j.jpba.2020.113234]

6. Wensen Zhang, Na Cui, Fazhi Su, Yanping Sun, Biao Li, Meng Liu, Yuanning Zeng, Bingyou Yang, Qiuhong Wang, Haixue Kuang.  (2024)  Gut microbial analysis combined with metabolomics reveal the mechanism of stachyose on blood deficiency syndrome in rats.  Arabian Journal of Chemistry,      [PMID:] [10.1016/j.arabjc.2024.105757]

7. Ruxi Gao, Fanyi Wang, Xiang Liu, Chu Yuan, Guoshun Shan.  (2025)  Rehmanniae Radix Praeparata in Blood Deficiency Syndrome: UPLC-Q-TOF-MS Profiling, Network Pharmacology, and PI3K-AKT Activation.  INTERNATIONAL JOURNAL OF MOLECULAR SCIENCES,  26  (8): (3914).  [PMID:40332770] [10.3390/ijms26083914]

8. Cuiping Xu, Hao Cui, Qionglian Fang, Pengfei Tu, Xiuming Cui.  (2025)  Steamed Panax notoginseng Saponins Ameliorate Cyclophosphamide-Induced Anemia by Attenuating Gut-Liver Injury and Activating the cAMP/PI3K/AKT Signaling Pathway.  Nutrients,  17  (21): (3335).  [PMID:41228409] [10.3390/nu17213335]