| 发明名称 | 2-[2-(1-氯环丙基)-3-(2-氯苯基)-2-羟基丙基]-2,4-二氢-3H-1,2,4-三唑-3-硫酮的晶形Ⅱ | ||
| 摘要 | 本发明涉及式(A)2-[2-(1-氯-环丙基)-3-(2-氯苯基)-2-羟基-丙基]-2，4-二氢-3H-1，2，4-三唑-3-硫酮的晶形II、其制备方法及其用于防治不需要的微生物的用途。 | ||
| 申请公布号 | CN1681390B | 申请公布日期 | 2010.05.26 |
| 申请号 | CN03822449.6 | 申请日期 | 2003.07.10 |
| 申请人 | 拜尔农作物科学股份公司 | 发明人 | E·赛德尔;R·弗美尔;K·哈赛纳克;B·奥勒尼克 |
| 分类号 | C07D249/12(2006.01)I;A01N43/653(2006.01)I;A01P1/00(2006.01)I;A01P3/00(2006.01)I | 主分类号 | C07D249/12(2006.01)I |
| 代理机构 | 中国专利代理(香港)有限公司 72001 | 代理人 | 张元忠;王景朝 |
| 主权项 | 1.式(A)2-[2-(1-氯环丙基)-3-(2-氯苯基)-2-羟基丙基]-2，4-二氢-3H-1，2，4-三唑-3-硫酮的晶形II，<img file="F038224496C00011.GIF" wi="800" he="362" />其特征在于a)在下列波数[cm<sup>-1</sup>]处具有拉曼光谱中的峰最大值<tables num="0001"><table><tgroup cols="4"><colspec colname="c001" colwidth="25%" /><colspec colname="c002" colwidth="25%" /><colspec colname="c003" colwidth="25%" /><colspec colname="c004" colwidth="25%" /><thead><row><entry morerows="1"> 3220</entry><entry morerows="1"> 1375</entry><entry morerows="1"> 1101</entry><entry morerows="1"> 876</entry></row></thead><tbody><row><entry morerows="1"> 3151</entry><entry morerows="1"> 1351</entry><entry morerows="1"> 1065</entry><entry morerows="1"> 869</entry></row><row><entry morerows="1"> 3063</entry><entry morerows="1"> 1339</entry><entry morerows="1"> 1052</entry><entry morerows="1"> 849</entry></row><row><entry morerows="1"> 3016</entry><entry morerows="1"> 1324</entry><entry morerows="1"> 1038</entry><entry morerows="1"> 822</entry></row><row><entry morerows="1"> 2927</entry><entry morerows="1"> 1290</entry><entry morerows="1"> 1032</entry><entry morerows="1"> 796</entry></row><row><entry morerows="1"> 1542</entry><entry morerows="1"> 1220</entry><entry morerows="1"> 1001</entry><entry morerows="1"> 782</entry></row><row><entry morerows="1"> 1476</entry><entry morerows="1"> 1204</entry><entry morerows="1"> 963</entry><entry morerows="1"> 759</entry></row><row><entry morerows="1"> 1455</entry><entry morerows="1"> 1184</entry><entry morerows="1"> 954</entry><entry morerows="1"> 752</entry></row><row><entry morerows="1"> 1445</entry><entry morerows="1"> 1169</entry><entry morerows="1"> 922</entry><entry morerows="1"> 748</entry></row><row><entry morerows="1"> 1424</entry><entry morerows="1"> 1137</entry><entry morerows="1"> 912</entry><entry morerows="1"> 725</entry></row><row><entry morerows="1"> 1407</entry><entry morerows="1"> 1123</entry><entry morerows="1"> 889</entry><entry morerows="1"> 680</entry></row></tbody></tgroup></table></tables>b)具有下列键长[<img file="F038224496C00012.GIF" wi="42" he="52" />]和键角[°]<img file="F038224496C00021.GIF" wi="211" he="600" /><tables num="0002"><table><tgroup cols="2"><colspec colname="c001" colwidth="60%" /><colspec colname="c002" colwidth="38%" /><thead><row><entry morerows="1"> 键</entry><entry morerows="1"> 角[°]</entry></row></thead><tbody><row><entry morerows="1"> C(5)-N(1)-N(2)</entry><entry morerows="1"> 112.8(2)</entry></row><row><entry morerows="1"> N(2)-N(1)-C(6)</entry><entry morerows="1"> 120.6(2)</entry></row><row><entry morerows="1"> N(2)-C(3)-N(4)</entry><entry morerows="1"> 111.9(2)</entry></row><row><entry morerows="1"> N(1)-C(5)-N(4)</entry><entry morerows="1"> 103.6(2)</entry></row><row><entry morerows="1"> N(4)-C(5)-S(5)</entry><entry morerows="1"> 127.8(2)</entry></row><row><entry morerows="1"> O(7)-C(7)-C(6)</entry><entry morerows="1"> 104.8(2)</entry></row><row><entry morerows="1"> C(6)-C(7)-C(15)</entry><entry morerows="1"> 113.6(2)</entry></row></tbody></tgroup></table></tables><tables num="0003"><table><tgroup cols="2"><colspec colname="c001" colwidth="60%" /><colspec colname="c002" colwidth="38%" /><thead><row><entry morerows="1"> 键</entry><entry morerows="1"> 角[°]</entry></row></thead><tbody><row><entry morerows="1"> C(6)-C(7)-C(8)</entry><entry morerows="1"> 109.9(2)</entry></row><row><entry morerows="1"> C(9)-C(8)-C(7)</entry><entry morerows="1"> 117.2(2)</entry></row><row><entry morerows="1"> C(14)-C(9)-C(8)</entry><entry morerows="1"> 119.6(2)</entry></row><row><entry morerows="1"> C(11)-C(10)-C(9)</entry><entry morerows="1"> 122.4(2)</entry></row><row><entry morerows="1"> C(9)-C(10)-Cl(10)</entry><entry morerows="1"> 120.1(3)</entry></row><row><entry morerows="1"> C(13)-C(12)-C(11)</entry><entry morerows="1"> 119.9(3)</entry></row><row><entry morerows="1"> C(13)-C(14)-C(9)</entry><entry morerows="1"> 121.9(3)</entry></row><row><entry morerows="1"> C(16)-C(15)-C(7)</entry><entry morerows="1"> 123.2(2)</entry></row><row><entry morerows="1"> C(16)-C(15)-Cl(15)</entry><entry morerows="1"> 115.7(2)</entry></row><row><entry morerows="1"> C(7)-C(15)-Cl(15)</entry><entry morerows="1"> 112.2(2)</entry></row><row><entry morerows="1"> C(15)-C(17)-C(16)</entry><entry morerows="1"> 59.0(2)</entry></row><row><entry morerows="1"> C(5)-N(1)-C(6)</entry><entry morerows="1"> 126.6(2)</entry></row><row><entry morerows="1"> C(3)-N(2)-N(1)</entry><entry morerows="1"> 103.5(2)</entry></row><row><entry morerows="1"> C(3)-N(4)-C(5)</entry><entry morerows="1"> 108.2(2)</entry></row><row><entry morerows="1"> N(1)-C(5)-S(5)</entry><entry morerows="1"> 128.5(2)</entry></row><row><entry morerows="1"> N(1)-C(6)-C(7)</entry><entry morerows="1"> 113.3(2)</entry></row><row><entry morerows="1"> O(7)-C(7)-C(15)</entry><entry morerows="1"> 108.9(2)</entry></row><row><entry morerows="1"> O(7)-C(7)-C(8)</entry><entry morerows="1"> 111.7(2)</entry></row><row><entry morerows="1"> C(15)-C(7)-C(8)</entry><entry morerows="1"> 108.1(2)</entry></row><row><entry morerows="1"> C(14)-C(9)-C(10)</entry><entry morerows="1"> 116.5(2)</entry></row></tbody></tgroup></table></tables><tables num="0004"><table><tgroup cols="2"><colspec colname="c001" colwidth="60%" /><colspec colname="c002" colwidth="38%" /><thead><row><entry morerows="1"> 键</entry><entry morerows="1"> 角[°]</entry></row></thead><tbody><row><entry morerows="1"> C(10)-C(9)-C(8)</entry><entry morerows="1"> 123.9(2)</entry></row><row><entry morerows="1"> C(11)-C(10)-Cl(10)</entry><entry morerows="1"> 117.4(2)</entry></row><row><entry morerows="1"> C(10)-C(11)-C(12)</entry><entry morerows="1"> 119.5(3)</entry></row><row><entry morerows="1"> C(12)-C(13)-C(14)</entry><entry morerows="1"> 119.8(3)</entry></row><row><entry morerows="1"> C(16)-C(15)-C(17)</entry><entry morerows="1"> 61.1(2)</entry></row><row><entry morerows="1"> C(17)-C(15)-C(7)</entry><entry morerows="1"> 120.6(2)</entry></row><row><entry morerows="1"> C(17)-C(15)-Cl(15)</entry><entry morerows="1"> 115.1(2)</entry></row><row><entry morerows="1"> C(15)-C(16)-C(17)</entry><entry morerows="1"> 59.9(2)</entry></row></tbody></tgroup></table></tables>c)具有下列晶胞参数的单胞<img file="F038224496C00031.GIF" wi="310" he="62" />α＝90°<img file="F038224496C00032.GIF" wi="326" he="62" />β＝92.651(6)°<img file="F038224496C00033.GIF" wi="373" he="62" />γ＝90°d)熔点为138.3℃和e)颗粒密度为1.471Mg/m<sup>3</sup>。 | ||
| 地址 | 德国蒙海姆 | ||