3-(Bromomethyl)-2,4,10-trioxatricyclo[3.3.1.13.7]decane - CAS 157371-80-7
Catalog: |
BB011315 |
Product Name: |
3-(Bromomethyl)-2,4,10-trioxatricyclo[3.3.1.13.7]decane |
CAS: |
157371-80-7 |
Synonyms: |
3-(bromomethyl)-2,4,10-trioxatricyclo[3.3.1.13,7]decane |
IUPAC Name: | 3-(bromomethyl)-2,4,10-trioxatricyclo[3.3.1.13,7]decane |
Description: | 3-(Bromomethyl)-2,4,10-trioxatricyclo[3.3.1.13.7]decane (CAS# 157371-80-7) is an intermediate in the synthesis of orthocarboxylic esters of cis-phloroglucitol. |
Molecular Weight: | 235.08 |
Molecular Formula: | C8H11BrO3 |
Canonical SMILES: | C1C2CC3CC1OC(O2)(O3)CBr |
InChI: | InChI=1S/C8H11BrO3/c9-4-8-10-5-1-6(11-8)3-7(2-5)12-8/h5-7H,1-4H2 |
InChI Key: | CSXFBEUWUQOEEC-UHFFFAOYSA-N |
Boiling Point: | 266.3 ℃ at 760 mmHg |
Melting Point: | 95-97 ℃ |
Purity: | 95 % |
Density: | 1.66 g/cm3 |
Appearance: | Light grey crystals |
Storage: | 2-8 ℃ |
MDL: | MFCD00077628 |
LogP: | 1.40180 |
GHS Hazard Statement: | H315 (100%): Causes skin irritation [Warning Skin corrosion/irritation] |
Precautionary Statement: | P261, P264, P271, P280, P302+P352, P304+P340, P305+P351+P338, P312, P321, P332+P313, P337+P313, P362, P403+P233, P405, and P501 |
Signal Word: | Warning |
Publication Number | Title | Priority Date |
US-10759907-B2 | Defined monomer sequence polymers | 20150910 |
EP-1925620-A1 | Polymerisation of ethylene and alpha olefins with single site catalysts having an anionic scorpion-like ligand | 20061124 |
EP-2089399-B1 | Polymerisation of ethylene and alpha olefins with single site catalysts having an anionic scorpion-like ligand | 20061124 |
US-2010298122-A1 | Polymerisation of Ethylene and Alpha Olefins with Single Site Catalysts having an Anionic Scorpion-Like Ligand | 20061124 |
EP-1902074-A1 | Single site catalyst systems having a scorpion-like structure | 20050707 |
Complexity: | 165 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 233.98916 |
Formal Charge: | 0 |
Heavy Atom Count: | 12 |
Hydrogen Bond Acceptor Count: | 3 |
Hydrogen Bond Donor Count: | 0 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 233.98916 |
Rotatable Bond Count: | 1 |
Topological Polar Surface Area: | 27.7 Å2 |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | 1.2 |
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