7-Aminoheptanoic Acid - ≥98%(T) , CAS No.929-17-9

CAS: 929-17-9 Cat. No.: A151309 Molecular Weight: 145.2 Beilstein Registry Number: 906887 EC Number: 213-197-5

GRADE & PURITY ≥98%(T)

Synonyms

7-Aminoenanthic acid | 4-04-00-02791 (Beilstein Handbook Reference) | 7-Aminoheptanoic acid | 7-Amino-heptanoic acid | 7-Aminoheptanoic acid, purum, >=97.0% (CHN) | Kyselina 7-aminoenanthova | H-Ahp(7)-OH | EN300-17159 | Amino-enanthylic acid | 7-Aminohep

Storage

Argon charged,Room temperature

Shipped In

Normal

Specifications

Synonyms

7-Aminoenanthic acid | 4-04-00-02791 (Beilstein Handbook Reference) | 7-Aminoheptanoic acid | 7-Amino-heptanoic acid | 7-Aminoheptanoic acid, purum, >=97.0% (CHN) | Kyselina 7-aminoenanthova | H-Ahp(7)-OH | EN300-17159 | Amino-enanthylic acid | 7-Aminohep

Specifications & Purity

≥98%(T)

Storage

Argon charged, Room temperature

Shipped In

Normal

Purity

≥98%(T)

Names and Identifiers

• Pubchem Sid: 488181869
• Pubchem Sid Url: https://pubchem.ncbi.nlm.nih.gov/substance/488181869
• Canonical Smiles: C(CCCN)CCC(=O)O
• IUPAC Name: 7-aminoheptanoic acid
• InChIKey: XDOLZJYETYVRKV-UHFFFAOYSA-N
• INCHI: 1S/C7H15NO2/c8-6-4-2-1-3-5-7(9)10/h1-6,8H2,(H,9,10)
• Isomeric SMILES: C(CCCN)CCC(=O)O
• WGK Germany: 2
• RTECS: MJ1770000
• Molecular Weight: 145.2
• Beilstein: 906887
• Reaxy-Rn: 906887
• Reaxys-RN_link_address: https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=906887&ln=

Taxonomic Classification

Taxonomy Tree

• Kingdom Organic compounds
  • Superclass Lipids and lipid-like molecules
    • Class Fatty Acyls
      • Subclass Fatty acids and conjugates

• Kingdom: Organic compounds
• Superclass: Lipids and lipid-like molecules
• Class: Fatty Acyls
• Subclass: Fatty acids and conjugates
• Intermediate Tree Nodes: Not available
• Direct Parent: Medium-chain fatty acids
• Alternative Parents: Amino fatty acids Straight chain fatty acids Amino acids Monocarboxylic acids and derivatives Carboxylic acids Organopnictogen compounds Organic oxides Monoalkylamines Hydrocarbon derivatives Carbonyl compounds
• Molecular Framework: Aliphatic acyclic compounds
• Substituents: Medium-chain fatty acid - Amino fatty acid - Straight chain fatty acid - Amino acid or derivatives - Amino acid - Carboxylic acid derivative - Carboxylic acid - Monocarboxylic acid or derivatives - Primary amine - Organooxygen compound - Organonitrogen compound - Organic nitrogen compound - Primary aliphatic amine - Amine - Carbonyl group - Organic oxygen compound - Organopnictogen compound - Organic oxide - Hydrocarbon derivative - Aliphatic acyclic compound
• Description: This compound belongs to the class of organic compounds known as medium-chain fatty acids. These are fatty acids with an aliphatic tail that contains between 4 and 12 carbon atoms.
• 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)

SLC6A1 Tclin GABA transporter 1 (308 Activities)

Discover Target: SLC6A1

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

SLC6A11 Tchem GABA transporter 3 (176 Activities)

Discover Target: SLC6A11

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 water
• Sensitivity: Air sensitive
• Melt Point(°C): 192-195°C
• Molecular Weight: 145.200 g/mol
• XLogP3: -3.000
• Hydrogen Bond Donor Count: 2
• Hydrogen Bond Acceptor Count: 3
• Rotatable Bond Count: 6
• Exact Mass: 145.11 Da
• Monoisotopic Mass: 145.11 Da
• Topological Polar Surface Area: 63.300 Ų
• Heavy Atom Count: 10
• Formal Charge: 0
• Complexity: 93.600
• 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