1-[3-(Trimethoxysilyl)propyl]urea - ≥97% , CAS No.23843-64-3

CAS: 23843-64-3 Cat. No.: T162292 Molecular Weight: 222.32 EC Number: 245-904-8 PubChem CID: 90280

GRADE & PURITY ≥97%

Synonyms

[3-(Trimethoxysilyl)propyl]urea | (3-Ureidopropyl)trimethoxysilane | ureidopropyltrimethoxysilane | 3-trimethoxysilylpropylurea | 1-(3-(Trimethoxysilyl)propyl)urea | (3-(Trimethoxysilyl)propyl)urea

Storage

Argon charged,Room temperature

Shipped In

Normal

Specifications

Synonyms

[3-(Trimethoxysilyl)propyl]urea | (3-Ureidopropyl)trimethoxysilane | ureidopropyltrimethoxysilane | 3-trimethoxysilylpropylurea | 1-(3-(Trimethoxysilyl)propyl)urea | (3-(Trimethoxysilyl)propyl)urea

Specifications & Purity

≥97%

Storage

Argon charged, Room temperature

Shipped In

Normal

Purity

≥97%

Names and Identifiers

• Canonical Smiles: CO[Si](CCCNC(=O)N)(OC)OC
• IUPAC Name: 3-trimethoxysilylpropylurea
• InChIKey: LVACOMKKELLCHJ-UHFFFAOYSA-N
• INCHI: 1S/C7H18N2O4Si/c1-11-14(12-2,13-3)6-4-5-9-7(8)10/h4-6H2,1-3H3,(H3,8,9,10)
• Isomeric SMILES: CO[Si](CCCNC(=O)N)(OC)OC
• WGK Germany: 3
• PubChem CID: 90280
• Molecular Weight: 222.32
• Reaxy-Rn: 2093565

Taxonomic Classification

Taxonomy Tree

• Kingdom Organic compounds
  • Superclass Organometallic compounds
    • Class Organometalloid compounds
      • Subclass Organosilicon compounds
        • Level5 Alkoxysilanes
          • Level6 Trialkoxysilanes

• Kingdom: Organic compounds
• Superclass: Organometallic compounds
• Class: Organometalloid compounds
• Subclass: Organosilicon compounds
• Intermediate Tree Nodes: Alkoxysilanes
• Direct Parent: Trialkoxysilanes
• Alternative Parents: Ureas Silyl ethers Organoheterosilanes Organic metalloid salts Organopnictogen compounds Organonitrogen compounds Organic oxides Hydrocarbon derivatives Carbonyl compounds
• Molecular Framework: Aliphatic acyclic compounds
• Substituents: Trialkoxysilane - Carbonic acid derivative - Urea - Silyl ether - Organoheterosilane - Organic metalloid salt - Carbonyl group - Hydrocarbon derivative - Organic salt - Organic oxide - Organopnictogen compound - Organic oxygen compound - Organooxygen compound - Organonitrogen compound - Organic nitrogen compound - Aliphatic acyclic compound
• Description: This compound belongs to the class of organic compounds known as trialkoxysilanes. These are organosilicon compounds with the general formula RO[Si](R')(OR'')OR''' (R-R''' = aliphatic organyl group).
• 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

• Sensitivity: Moisture sensitive.
• Refractive Index: n20/D 1.46(lit.)
• Flash Point(°F): 210.2 °F
• Flash Point(°C): 98°C
• Boil Point(°C): 217-250 °C(lit.)
• Molecular Weight: 222.310 g/mol
• Hydrogen Bond Donor Count: 2
• Hydrogen Bond Acceptor Count: 4
• Rotatable Bond Count: 7
• Exact Mass: 222.104 Da
• Monoisotopic Mass: 222.104 Da
• Topological Polar Surface Area: 82.800 Ų
• Heavy Atom Count: 14
• Formal Charge: 0
• Complexity: 167.000
• 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

XLogP3

References

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