2-amino-N-hydroxypropanamide - ≥95% , CAS No.16707-85-0

CAS: 16707-85-0 Cat. No.: A299986 Formula: C₃H₈N₂O₂ Molecular Weight: 104.11 EC Number: 192-335-5

GRADE & PURITY ≥95%

Synonyms

2-amino-N-hydroxypropanamide|16707-85-0|2-amino-N-hydroxy-propanamide|15465-70-0|DL-Alanine hydroxamate|NSC3839|dl-alanine hydroxamic|SCHEMBL245635|NSC-3839|MFCD00056121|NSC111687|NSC111688|AKOS013309379|8G-314S|AT14821|NSC-111687|NSC-111688|EN300-117057

Storage

Room temperature

Shipped In

Normal

Specifications

Synonyms

2-amino-N-hydroxypropanamide | 16707-85-0 | 2-amino-N-hydroxy-propanamide | 15465-70-0 | DL-Alanine hydroxamate | NSC3839 | dl-alanine hydroxamic | SCHEMBL245635 | NSC-3839 | MFCD00056121 | NSC111687 | NSC111688 | AKOS013309379 | 8G-314S | AT14821 | NSC-111687 | NSC-111688 | EN300-117057

Specifications & Purity

≥95%

Storage

Room temperature

Shipped In

Normal

Purity

≥95%

Names and Identifiers

Canonical Smiles

CC(C(=O)NO)N

IUPAC Name

2-amino-N-hydroxypropanamide

InChIKey

BAAQJFBTHFOHLY-UHFFFAOYSA-N

INCHI

1S/C3H8N2O2/c1-2(4)3(6)5-7/h2,7H,4H2,1H3,(H,5,6)

Isomeric SMILES

CC(C(=O)NO)N

Molecular Weight

104.11

Reaxy-Rn

1701246

Reaxys-RN_link_address

https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=1701246&ln=

Taxonomic Classification

Taxonomy Tree

• Kingdom Organic compounds
  • Superclass Organic acids and derivatives
    • Class Carboxylic acids and derivatives
      • Subclass Amino acids, peptides, and analogues
        • Level5 Amino acids and derivatives
          • Level6 Alpha amino acids and derivatives
            • Level7 Alanine and derivatives

• Kingdom: Organic compounds
• Superclass: Organic acids and derivatives
• Class: Carboxylic acids and derivatives
• Subclass: Amino acids, peptides, and analogues
• Intermediate Tree Nodes: Amino acids and derivatives - Alpha amino acids and derivatives
• Direct Parent: Alanine and derivatives
• Alternative Parents: Hydroxamic acids Organopnictogen compounds Organic oxides Monoalkylamines Hydrocarbon derivatives Carbonyl compounds
• Molecular Framework: Aliphatic acyclic compounds
• Substituents: Alanine or derivatives - Hydroxamic acid - Organic nitrogen compound - Organic oxygen compound - Organopnictogen compound - Organic oxide - Hydrocarbon derivative - Primary amine - Organooxygen compound - Organonitrogen compound - Primary aliphatic amine - Carbonyl group - Amine - Aliphatic acyclic compound
• Description: This compound belongs to the class of organic compounds known as alanine and derivatives. These are compounds containing alanine or a derivative thereof resulting from reaction of alanine at the amino group or the carboxy group, or from the replacement of any hydrogen of glycine by a heteroatom.
• 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

Chemical and Physical Properties

• Molecular Weight: 104.110 g/mol
• XLogP3: -1.500
• Hydrogen Bond Donor Count: 3
• Hydrogen Bond Acceptor Count: 3
• Rotatable Bond Count: 1
• Exact Mass: 104.059 Da
• Monoisotopic Mass: 104.059 Da
• Topological Polar Surface Area: 75.400 Ų
• Heavy Atom Count: 7
• Formal Charge: 0
• Complexity: 73.300
• Isotope Atom Count: 0
• Defined Atom Stereocenter Count: 0
• Undefined Atom Stereocenter Count: 1
• Defined Bond Stereocenter Count: 0
• Undefined Bond Stereocenter Count: 0
• The total count of all stereochemical bonds: 0
• Covalently-Bonded Unit Count: 1

Frequently Asked Questions

What is the purity of this product?

This product is supplied at ≥95% purity (chemical assay). Lot-specific values are stated on the Certificate of Analysis.

How should this product be stored?

Store at room temperature.

How is this product shipped?

This product ships under standard ambient conditions. No temperature-controlled packaging is required.

What are the CAS number, molecular formula and molecular weight?

The CAS Number is 16707-85-0, the molecular formula is C3H8N2O2, and the molecular weight is 104.11 g/mol. InChIKey BAAQJFBTHFOHLY-UHFFFAOYSA-N.

What documentation is provided?

Available product documentation, including Certificates of Analysis (COA), Safety Data Sheets (SDS), and specification sheets, is shown in the product document area. Document availability and access follow the current site policy.