3-Bromo-5-(dimethoxymethyl)pyridine - CAS 163163-79-9
Catalog: |
BB011956 |
Product Name: |
3-Bromo-5-(dimethoxymethyl)pyridine |
CAS: |
163163-79-9 |
Synonyms: |
3-bromo-5-(dimethoxymethyl)pyridine |
IUPAC Name: | 3-bromo-5-(dimethoxymethyl)pyridine |
Description: | 3-Bromo-5-(dimethoxymethyl)pyridine (CAS# 163163-79-9) is a useful research chemical. |
Molecular Weight: | 232.07 |
Molecular Formula: | C8H10BrNO2 |
Canonical SMILES: | COC(C1=CC(=CN=C1)Br)OC |
InChI: | InChI=1S/C8H10BrNO2/c1-11-8(12-2)6-3-7(9)5-10-4-6/h3-5,8H,1-2H3 |
InChI Key: | BNRIHZWATOCKDB-UHFFFAOYSA-N |
Boiling Point: | 249.557 ℃ at 760 mmHg |
Density: | 1.436 g/cm3 |
Appearance: | Liquid |
MDL: | MFCD10699139 |
LogP: | 2.13550 |
GHS Hazard Statement: | H302 (100%): Harmful if swallowed [Warning Acute toxicity, oral] |
Precautionary Statement: | P264, P270, P301+P317, P330, and P501 |
Signal Word: | Warning |
Publication Number | Title | Priority Date |
US-2005209197-A1 | Cellular accumulation of phosphonate analogs of HIV protease inhibitor compounds | 20020426 |
US-2005239054-A1 | Method and compositions for identifying anti-HIV therapeutic compounds | 20020426 |
US-2007010489-A1 | Cellular accumulation of phosphonate analogs of hiv protease inhibitor compounds | 20020426 |
US-7649015-B2 | Cellular accumulation of phosphonate analogs of HIV protease inhibitor compounds | 20020426 |
Complexity: | 130 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 230.98949 |
Formal Charge: | 0 |
Heavy Atom Count: | 12 |
Hydrogen Bond Acceptor Count: | 3 |
Hydrogen Bond Donor Count: | 0 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 230.98949 |
Rotatable Bond Count: | 3 |
Topological Polar Surface Area: | 31.4 |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | 1.2 |
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