1-(6-Bromo-3-pyridyl)-4-methylpiperazine - CAS 879488-53-6
Catalog: |
BB038696 |
Product Name: |
1-(6-Bromo-3-pyridyl)-4-methylpiperazine |
CAS: |
879488-53-6 |
Synonyms: |
1-(6-bromo-3-pyridinyl)-4-methylpiperazine; 1-(6-bromopyridin-3-yl)-4-methylpiperazine |
IUPAC Name: | 1-(6-bromopyridin-3-yl)-4-methylpiperazine |
Description: | 1-(6-Bromo-3-pyridyl)-4-methylpiperazine (CAS# 879488-53-6) is a useful synthetic compound. |
Molecular Weight: | 256.14 |
Molecular Formula: | C10H14BrN3 |
Canonical SMILES: | CN1CCN(CC1)C2=CN=C(C=C2)Br |
InChI: | InChI=1S/C10H14BrN3/c1-13-4-6-14(7-5-13)9-2-3-10(11)12-8-9/h2-3,8H,4-7H2,1H3 |
InChI Key: | VCDWKCPGKQANIF-UHFFFAOYSA-N |
LogP: | 1.59880 |
GHS Hazard Statement: | H302 (100%): Harmful if swallowed [Warning Acute toxicity, oral] |
Precautionary Statement: | P261, P264, P270, P271, P280, P301+P312, P302+P352, P304+P340, P305+P351+P338, P310, P312, P321, P330, P332+P313, P362, P403+P233, P405, and P501 |
Signal Word: | Danger |
Publication Number | Title | Priority Date |
EP-1798229-A1 | Substituted biphenyl derivative | 20040907 |
JP-2006104191-A | Substituted biphenyl derivatives | 20040907 |
US-2007275968-A1 | Substituted Biphenyl Derivative | 20040907 |
Complexity: | 180 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 255.03711 |
Formal Charge: | 0 |
Heavy Atom Count: | 14 |
Hydrogen Bond Acceptor Count: | 3 |
Hydrogen Bond Donor Count: | 0 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 255.03711 |
Rotatable Bond Count: | 1 |
Topological Polar Surface Area: | 19.4 Å2 |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | 1.8 |
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