(S)-(+)-Tetrahydrofurfurylamine - ≥98% , CAS No.7175-81-7

CAS: 7175-81-7 Cat. No.: T113724 Molecular Weight: 101.15 EC Number: 627-367-5 PubChem CID: 641530

GRADE & PURITY ≥98%

Synonyms

(S)-2-aminomethyltetrahydrofuran | (2S)-tetrahydrofurfurylamine | (S)-(+)-2-(Aminomethyl)tetrahydrofuran | T2552 | (S)-(+)-Tetrahydrofurfurylamine | SCHEMBL226122 | 1-((2S)-tetrahydrofuran-2-yl)methanamine | (S)-tetrahydrofuran-2-yl-methylamine | S-(tetra

Storage

Argon charged,Room temperature

Shipped In

Normal

Specifications

Synonyms

(S)-2-aminomethyltetrahydrofuran | (2S)-tetrahydrofurfurylamine | (S)-(+)-2-(Aminomethyl)tetrahydrofuran | T2552 | (S)-(+)-Tetrahydrofurfurylamine | SCHEMBL226122 | 1-((2S)-tetrahydrofuran-2-yl)methanamine | (S)-tetrahydrofuran-2-yl-methylamine | S-(tetra

Specifications & Purity

≥98%

Storage

Argon charged, Room temperature

Shipped In

Normal

Purity

≥98%

Names and Identifiers

• Pubchem Sid: 504759708
• Pubchem Sid Url: https://pubchem.ncbi.nlm.nih.gov/substance/504759708
• Canonical Smiles: C1CC(OC1)CN
• IUPAC Name: [(2S)-oxolan-2-yl]methanamine
• InChIKey: YNOGYQAEJGADFJ-YFKPBYRVSA-N
• INCHI: 1S/C5H11NO/c6-4-5-2-1-3-7-5/h5H,1-4,6H2/t5-/m0/s1
• Isomeric SMILES: C1C[C@H](OC1)CN
• WGK Germany: 3
• PubChem CID: 641530
• UN Number: 2943
• Molecular Weight: 101.15
• Reaxy-Rn: 5725996

Taxonomic Classification

Taxonomy Tree

• Kingdom Organic compounds
  • Superclass Organoheterocyclic compounds
    • Class Tetrahydrofurans

• Kingdom: Organic compounds
• Superclass: Organoheterocyclic compounds
• Class: Tetrahydrofurans
• Subclass: Not available
• Intermediate Tree Nodes: Not available
• Direct Parent: Tetrahydrofurans
• Alternative Parents: Oxacyclic compounds Dialkyl ethers Organopnictogen compounds Monoalkylamines Hydrocarbon derivatives
• Molecular Framework: Aliphatic heteromonocyclic compounds
• Substituents: Tetrahydrofuran - Oxacycle - Ether - Dialkyl ether - Organic nitrogen compound - Organic oxygen compound - Organopnictogen compound - Hydrocarbon derivative - Primary amine - Organooxygen compound - Organonitrogen compound - Primary aliphatic amine - Amine - Aliphatic heteromonocyclic compound
• Description: This compound belongs to the class of organic compounds known as tetrahydrofurans. These are heterocyclic compounds containing a saturated, aliphatic, five-membered ring where a carbon is replaced by an oxygen.
• 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

• Sensitivity: Air Sensitive；Moisture sensitive
• Refractive Index: 1.455
• Specific Rotation[α]: 15 ° (C=2, MeOH)
• Flash Point(°F): 114.8 °F
• Flash Point(°C): 45 °C
• Boil Point(°C): 55 °C/18 mmHg (lit.)
• Molecular Weight: 101.150 g/mol
• XLogP3: -0.300
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 2
• Rotatable Bond Count: 1
• Exact Mass: 101.084 Da
• Monoisotopic Mass: 101.084 Da
• Topological Polar Surface Area: 35.300 Ų
• Heavy Atom Count: 7
• Formal Charge: 0
• Complexity: 56.000
• Isotope Atom Count: 0
• Defined Atom Stereocenter Count: 1
• 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