(3,4-Dihydro-2H-pyran-6-yl)dimethylsilanol - ≥98% , CAS No.304669-35-0

CAS: 304669-35-0 Cat. No.: D356929 Molecular Weight: 158.27

GRADE & PURITY ≥98%

Synonyms

DTXSID00462568 | Silanol, (3,4-dihydro-2H-pyran-6-yl)dimethyl- | ZMDNGTLKIVNNCF-UHFFFAOYSA-N | (3,4-Dihydro-2H-pyran-6-yl)dimethylsilanol | AKOS025295092 | SCHEMBL319205 | 3,4-dihydro-2H-pyran-6-yl-hydroxy-dimethylsilane | Silanol, 1-(3,4-dihydro-2H-pyran

Storage

Store at 2-8°C,Argon charged

Shipped In

Wet ice

Specifications

Synonyms

DTXSID00462568 | Silanol, (3, 4-dihydro-2H-pyran-6-yl)dimethyl- | ZMDNGTLKIVNNCF-UHFFFAOYSA-N | (3, 4-Dihydro-2H-pyran-6-yl)dimethylsilanol | AKOS025295092 | SCHEMBL319205 | 3, 4-dihydro-2H-pyran-6-yl-hydroxy-dimethylsilane | Silanol, 1-(3, 4-dihydro-2H-pyran

Specifications & Purity

≥98%

Storage

Store at 2-8°C, Argon charged

Shipped In

Wet ice

This product requires cold chain shipping. Ground and other economy services are not available.

Purity

≥98%

Names and Identifiers

• Canonical Smiles: C[Si](C)(C1=CCCCO1)O
• IUPAC Name: 3,4-dihydro-2H-pyran-6-yl-hydroxy-dimethylsilane
• InChIKey: ZMDNGTLKIVNNCF-UHFFFAOYSA-N
• INCHI: 1S/C7H14O2Si/c1-10(2,8)7-5-3-4-6-9-7/h5,8H,3-4,6H2,1-2H3
• Isomeric SMILES: C[Si](C)(C1=CCCCO1)O
• WGK Germany: 3
• Molecular Weight: 158.27
• Reaxy-Rn: 8614749
• Reaxys-RN_link_address: https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=8614749&ln=

Taxonomic Classification

Taxonomy Tree

• Kingdom Organic compounds
  • Superclass Organometallic compounds
    • Class Organometalloid compounds
      • Subclass Organosilicon compounds
        • Level5 Silanols
          • Level6 Trialkylsilanols

• Kingdom: Organic compounds
• Superclass: Organometallic compounds
• Class: Organometalloid compounds
• Subclass: Organosilicon compounds
• Intermediate Tree Nodes: Silanols
• Direct Parent: Trialkylsilanols
• Alternative Parents: Ketene acetals Oxacyclic compounds Organoheterosilanes Organic metalloid salts Hydrocarbon derivatives
• Molecular Framework: Aliphatic heteromonocyclic compounds
• Substituents: Trialkylsilanol - Ketene acetal or derivatives - Organoheterosilane - Oxacycle - Organic metalloid salt - Organoheterocyclic compound - Organic oxygen compound - Hydrocarbon derivative - Organooxygen compound - Aliphatic heteromonocyclic compound
• Description: This compound belongs to the class of organic compounds known as trialkylsilanols. These are organosilicon compounds with the general formula HO[Si](R)(R')R'' where R, R' and R'' are alkyl groups.
• 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

• Refractive Index: 1.475
• Flash Point(°F): 195.8 °F
• Flash Point(°C): 91 °C
• Boil Point(°C): 54°C/0.8mm
• Molecular Weight: 158.270 g/mol
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 2
• Rotatable Bond Count: 1
• Exact Mass: 158.076 Da
• Monoisotopic Mass: 158.076 Da
• Topological Polar Surface Area: 29.500 Ų
• Heavy Atom Count: 10
• Formal Charge: 0
• Complexity: 152.000
• 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

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