2-Bromopropane-d₇ - ≥98 atom% D,≥98% , CAS No.39091-63-9

CAS: 39091-63-9 Cat. No.: B472006 분자식: (CD₃)₂CDBr 분자량: 130.03 EC 번호: 686-145-6

GRADE & PURITY ≥98 atom% D,≥98%

Synonyms

d7-2-bromopropane | 2-bromo(?H?)propane | 2-bromo-1,1,1,2,3,3,3-heptadeuteriopropane | SCHEMBL508929 | D98008 | Isopropyl-d7 bromide | 2-Bromopropane-d7 | 2-Bromopropane-d7, 98 atom % D | S-(-)-3-Aminoquinuclidinedihydrochloride

Storage

Protected from light,Argon charged,Room temperature

Shipped In

Normal

개요

Product Application:

Labelled analogue of 2-Bromopropane, a short chain alkyl halide used in organic synthesis primarily as an alkylating agent for introducing the isopropyl functional groups.

Specifications

동의어

d7-2-bromopropane | 2-bromo(?H?)propane | 2-bromo-1,1,1,2,3,3,3-heptadeuteriopropane | SCHEMBL508929 | D98008 | Isopropyl-d7 bromide | 2-Bromopropane-d7 | 2-Bromopropane-d7, 98 atom % D | S-(-)-3-Aminoquinuclidinedihydrochloride

사양 및 순도

≥98 atom% D,≥98%

보관 조건

Protected from light,Argon charged,Room temperature

배송

Normal

순수함

≥98 atom% D,≥98%

이름과 식별자

• Pubchem Sid: 504767916
• Pubchem Sid Url: https://pubchem.ncbi.nlm.nih.gov/substance/504767916
• 정식 스마일: CC(C)Br
• IUPAC Name: 2-bromo-1,1,1,2,3,3,3-heptadeuteriopropane
• InChIKey: NAMYKGVDVNBCFQ-YYWVXINBSA-N
• INCHI: 1S/C3H7Br/c1-3(2)4/h3H,1-2H3/i1D3,2D3,3D
• 이성체 SMILES: [2H]C([2H])([2H])C([2H])(C([2H])([2H])[2H])Br
• WGK 독일: 1
• 대체 CAS: 75-26-3
• 분자량: 130.03
• Reaxy-Rn: 741852
• Reaxys-RN_link_address: https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=741852&ln=

Taxonomic Classification

Taxonomy Tree

• Kingdom Organic compounds
  • Superclass Organohalogen compounds
    • 분류 Organobromides

• Kingdom: Organic compounds
• Superclass: Organohalogen compounds
• 분류: Organobromides
• Subclass: Not available
• Intermediate Tree Nodes: Not available
• Direct Parent: Organobromides
• Alternative Parents: Hydrocarbon derivatives Alkyl bromides
• Molecular Framework: Aliphatic acyclic compounds
• Substituents: Hydrocarbon derivative - Organobromide - Alkyl halide - Alkyl bromide - Aliphatic acyclic compound
• 설명: This compound belongs to the class of organic compounds known as organobromides. These are compounds containing a chemical bond between a carbon atom and a bromine 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

• 감도: Hygroscopic ；light sensitive
• 굴절률: n20/D 1.421 (lit.)
• 발화점(°F): 66.2 °F
• 발화점(°C): 19 °C
• 끓는점(°C): 59 °C (lit.)
• 녹는점(°C): -89 °C (lit.)
• 분자량: 130.030 g/mol
• XLogP3: 1.800
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 0
• Rotatable Bond Count: 0
• Exact Mass: 129.017 Da
• Monoisotopic Mass: 129.017 Da
• Topological Polar Surface Area: 0.000 Ų
• Heavy Atom Count: 4
• Formal Charge: 0
• Complexity: 10.800
• Isotope Atom Count: 7
• 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