Ethanolamine - ACS, ≥99% , CAS No.141-43-5

CAS: 141-43-5 Cat. No.: E103810 분자식: C₂H₇NO 분자량: 61.08 Beilstein Registry Number: 505944 EC 번호: 205-483-3

GRADE & PURITY ACS, ≥99%

Synonyms

1219802-89-7 | 2 Aminoethanol | 2 -aminoethanol | colamine | ethanolamin | Glycinol (monoethanolamine) | TROLAMINE IMPURITY A (EP IMPURITY) | beta-Aminoethyl alcohol | Caswell No. 426 | DTXCID202000 | Monoaethanolamin | 1-Amino-2-hydroxyethane | 3-phenyl-

Storage

Room temperature,Argon charged,Desiccated

Shipped In

FedEx DG Service

Specifications

동의어

1219802-89-7 | 2 Aminoethanol | 2 -aminoethanol | colamine | ethanolamin | Glycinol (monoethanolamine) | TROLAMINE IMPURITY A (EP IMPURITY) | beta-Aminoethyl alcohol | Caswell No. 426 | DTXCID202000 | Monoaethanolamin | 1-Amino-2-hydroxyethane | 3-phenyl-

사양 및 순도

ACS, ≥99%

보관 조건

Room temperature,Argon charged,Desiccated

배송

FedEx DG Service

등급

ACS

순수함

≥99%

이름과 식별자

Pubchem Sid

508811994

Pubchem Sid Url

https://pubchem.ncbi.nlm.nih.gov/substance/508811994

정식 스마일

C(CO)N

IUPAC Name

2-aminoethanol

InChIKey

HZAXFHJVJLSVMW-UHFFFAOYSA-N

INCHI

1S/C2H7NO/c3-1-2-4/h4H,1-3H2

이성체 SMILES

C(CO)N

WGK 독일

1

RTECS

KJ5775000

UN 번호

2491

포장 그룹

III

분자량

61.08

Beilstein

505944

Reaxy-Rn

505944

Reaxys-RN_link_address

https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=505944&ln=

Taxonomic Classification

Taxonomy Tree

• Kingdom Organic compounds
  • Superclass Organic nitrogen compounds
    • 분류 Organonitrogen compounds
      • Subclass Amines
        • Level5 Alkanolamines
          • Level6 1,2-aminoalcohols

• Kingdom: Organic compounds
• Superclass: Organic nitrogen compounds
• 분류: Organonitrogen compounds
• Subclass: Amines
• Intermediate Tree Nodes: Alkanolamines
• Direct Parent: 1,2-aminoalcohols
• Alternative Parents: Primary alcohols Organopnictogen compounds Monoalkylamines Hydrocarbon derivatives
• Molecular Framework: Aliphatic acyclic compounds
• Substituents: 1,2-aminoalcohol - Organic oxygen compound - Organopnictogen compound - Hydrocarbon derivative - Primary amine - Primary alcohol - Organooxygen compound - Primary aliphatic amine - Alcohol - Aliphatic acyclic compound
• 설명: This compound belongs to the class of organic compounds known as 1,2-aminoalcohols. These are organic compounds containing an alkyl chain with an amine group bound to the C1 atom and an alcohol group bound to the C2 atom.
• External Descriptors: a small molecule

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

관련 대상(인간)

ESR1 Tclin Estrogen receptor alpha (17718 Activities)

Discover Target: ESR1

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

ALDH1A1 Tchem Aldehyde dehydrogenase 1A1 (77053 Activities)

Discover Target: ALDH1A1

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

관련 대상(비인간)

Ppard Peroxisome proliferator-activated receptor delta (358 Activities)

Discover Target: Ppard

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

Slc6a8 Creatine transporter (104 Activities)

Discover Target: Slc6a8

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

Slc5a7 Choline transporter (45 Activities)

Discover Target: Slc5a7

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

작용 메커니즘

화학 및 물리적 특성

• 감도: Moisture sensitive.
• 굴절률: 1.454
• 발화점(°F): 195.8 °F
• 발화점(°C): 93 °C
• 끓는점(°C): 170°C
• 녹는점(°C): 10-11°C
• 분자량: 61.080 g/mol
• XLogP3: -1.300
• Hydrogen Bond Donor Count: 2
• Hydrogen Bond Acceptor Count: 2
• Rotatable Bond Count: 1
• Exact Mass: 61.0528 Da
• Monoisotopic Mass: 61.0528 Da
• Topological Polar Surface Area: 46.300 Ų
• Heavy Atom Count: 4
• Formal Charge: 0
• Complexity: 10.000
• 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