1-Ethyl-3-pyrrolidinol - >95.0%(GC) , CAS No.30727-14-1

CAS: 30727-14-1 Cat. No.: E138645 Formula: C₆H₁₃NO Peso molecolare: 115.17 Beilstein Registry Number: 21(3/4)5 Numero EC: 250-310-7 PubChem CID: 98203

Synonyms

EN300-1247678 | EINECS 250-310-7 | N-Ethyl-3-pyrrolidinol | DTXSID001314369 | 5-21-01-00016 (Beilstein Handbook Reference) | AKOS009156704 | AMY31539 | BCP11284 | MFCD00003179 | E0425 | J-018084 | 1-Ethyl-3-pyrrolidinol, 97% | WLN: T5NTJ A2 CQ | BRN 01029

Storage

Argon charged

Shipped In

Normal

Specifications

Sinonimi

EN300-1247678 | EINECS 250-310-7 | N-Ethyl-3-pyrrolidinol | DTXSID001314369 | 5-21-01-00016 (Beilstein Handbook Reference) | AKOS009156704 | AMY31539 | BCP11284 | MFCD00003179 | E0425 | J-018084 | 1-Ethyl-3-pyrrolidinol, 97% | WLN: T5NTJ A2 CQ | BRN 01029

Specifiche e purezza

>95.0%(GC)

Condizioni di conservazione di stoccaggio

Argon charged

Spedito in

Normal

Nomi e identificatori

Sorrisi canonici

CCN1CCC(C1)O

IUPAC Name

1-ethylpyrrolidin-3-ol

InChIKey

IDBNECMSCRAUNU-UHFFFAOYSA-N

INCHI

1S/C6H13NO/c1-2-7-4-3-6(8)5-7/h6,8H,2-5H2,1H3

Isomeri SMILES

CCN1CCC(C1)O

WGK Germania

3

RTECS

UY5685500

PubChem CID

98203

Peso molecolare

115.17

Beilstein

21(3/4)5

Reaxy-Rn

102963

Taxonomic Classification

Taxonomy Tree

• Kingdom Organic compounds
  • Superclass Organoheterocyclic compounds
    • Classe Pyrrolidines
      • Subclass N-alkylpyrrolidines

• Kingdom: Organic compounds
• Superclass: Organoheterocyclic compounds
• Classe: Pyrrolidines
• Subclass: N-alkylpyrrolidines
• Intermediate Tree Nodes: Not available
• Direct Parent: N-alkylpyrrolidines
• Alternative Parents: Trialkylamines Secondary alcohols 1,2-aminoalcohols Azacyclic compounds Organopnictogen compounds Hydrocarbon derivatives
• Molecular Framework: Aliphatic heteromonocyclic compounds
• Substituents: N-alkylpyrrolidine - Tertiary aliphatic amine - Tertiary amine - Secondary alcohol - 1,2-aminoalcohol - Azacycle - Organic nitrogen compound - Organic oxygen compound - Organopnictogen compound - Hydrocarbon derivative - Organooxygen compound - Organonitrogen compound - Amine - Alcohol - Aliphatic heteromonocyclic compound
• Descrizione: This compound belongs to the class of organic compounds known as n-alkylpyrrolidines. These are compounds containing a pyrrolidine moiety that is substituted at the N1-position with an alkyl group. Pyrrolidine is a five-membered saturated aliphatic heterocycle with one nitrogen atom and four 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

Proprietà chimiche e fisiche

• Sensibilità: Air Sensitive
• Indice di rifrazione: 1.47
• Punto di infiammabilità (°F): 165.2 °F
• Punto di infiammabilità (°C): 74 °C
• Punto di ebollizione (°C): 110 °C/35 mmHg
• Peso molecolare: 115.170 g/mol
• XLogP3: 0.100
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 2
• Rotatable Bond Count: 1
• Exact Mass: 115.1 Da
• Monoisotopic Mass: 115.1 Da
• Topological Polar Surface Area: 23.500 Ų
• Heavy Atom Count: 8
• Formal Charge: 0
• Complexity: 74.900
• 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

Domande frequenti

How should this product be stored?

Store under argon. It is supplied under an argon blanket; reseal under inert gas after each use.

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 30727-14-1, the molecular formula is C6H13NO, and the molecular weight is 115.17 g/mol. InChIKey IDBNECMSCRAUNU-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.