D-Threoninol - ≥97% , CAS No.44520-55-0

CAS: 44520-55-0 Cat. No.: S134976 분자식: CH₃CH(OH)CH(NH₂)CH₂OH 분자량: 105.14 EC 번호: 800-497-1 PubChem CID: 7020320

GRADE & PURITY ≥97%

Synonyms

AS-38502 | 1,3-Butanediol, 2-amino-, (2S,3S)- | MFCD00270215 | D-Threoninol | H-D-Thr-ol | AKOS016842496 | D(-)-Threoninol | D-Threoninol, 97% | SCHEMBL1620911 | J-501030 | (2S,3S)-2-Amino-butane-1,3-diol | (2S,3S)-2-aminobutane-1,3-diol | MUVQIIBPDFTEKM-

Storage

Room temperature

Shipped In

Normal

Specifications

동의어

AS-38502 | 1,3-Butanediol, 2-amino-, (2S,3S)- | MFCD00270215 | D-Threoninol | H-D-Thr-ol | AKOS016842496 | D(-)-Threoninol | D-Threoninol, 97% | SCHEMBL1620911 | J-501030 | (2S,3S)-2-Amino-butane-1,3-diol | (2S,3S)-2-aminobutane-1,3-diol | MUVQIIBPDFTEKM-

사양 및 순도

≥97%

보관 조건

Room temperature

배송

Normal

순수함

≥97%

이름과 식별자

• Pubchem Sid: 488196125
• 정식 스마일: CC(C(CO)N)O
• IUPAC Name: (2S,3S)-2-aminobutane-1,3-diol
• InChIKey: MUVQIIBPDFTEKM-IMJSIDKUSA-N
• INCHI: 1S/C4H11NO2/c1-3(7)4(5)2-6/h3-4,6-7H,2,5H2,1H3/t3-,4-/m0/s1
• 이성체 SMILES: C[C@@H]([C@H](CO)N)O
• WGK 독일: 3
• PubChem CID: 7020320
• 분자량: 105.14

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: Secondary alcohols Primary alcohols Monoalkylamines Hydrocarbon derivatives
• Molecular Framework: Aliphatic acyclic compounds
• Substituents: Secondary alcohol - 1,2-aminoalcohol - Organic oxygen 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: 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

화학 및 물리적 특성

• 특정 회전[α]: 4.5±0.5°, c = 1 in H2O
• 녹는점(°C): 57.5-61.5°C
• 분자량: 105.140 g/mol
• XLogP3: -1.600
• Hydrogen Bond Donor Count: 3
• Hydrogen Bond Acceptor Count: 3
• Rotatable Bond Count: 2
• Exact Mass: 105.079 Da
• Monoisotopic Mass: 105.079 Da
• Topological Polar Surface Area: 66.500 Ų
• Heavy Atom Count: 7
• Formal Charge: 0
• Complexity: 49.000
• Isotope Atom Count: 0
• Defined Atom Stereocenter Count: 2
• 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

자주 묻는 질문

How is this product shipped?

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