144830-14-8 ((Phenol,3-[(1R,2R)-2-[(dimethylamino)methyl]-1-hydroxycyclohexyl]-)

CAS号:
144830-14-8
英文名称:
Phenol,3-[(1R,2R)-2-[(dimethylamino)methyl]-1-hydroxycyclohexyl]-
分子式:
C15H23NO2
分子量:
249.34862446785

Phenol,3-[(1R,2R)-2-[(dimethylamino)methyl]-1-hydroxycyclohexyl]-(144830-14-8)名称与标识符

名称

英文别名:
Phenol,3-[(1R,2R)-2-[(dimethylamino)methyl]-1-hydroxycyclohexyl]-;(+)-O-Demethyltramadol;(+)-(1R,2R)-3-[2-(dimethylamino)-methyl-1-hydroxycyclohexyl]phenol;(1R,2R)-(+)-2-[(dimethylamino)methyl]-1-(3-hydroxyphenyl)cyclohexanol;1-(4-hydroxyphenyl)-7-oxo-6-(4-(2-oxo-1-piperidinyl)phenyl)-4,5,6,7-tetrahydro-1H-pyrazolo[3,4-c]pyridine-3-carboxamide;1-(4-hydroxy-phenyl)-7-oxo-6-[4-(2-oxo-piperidin-1-yl)-phenyl]-4,5,6,7-tetrahydro-1H-pyrazolo[3,4-c]pyridine-3-carboxylic acid amide;23-demycin;demycinosyltylosin;O-demycinosyltylosin;(+)-(1R,2R)-O-DESMETHYL TRAMADOL HCL;Desmetramadol, R,R-(+)-;UNII-2WA8F50C3F;O-DSMT;80456-81-1 (free base);9W28LW2ET5;Phenol, 3-(2-((dimethylamino)methyl)-1-hydroxycyclohexyl)-, (1R-cis)-;(+)-O-Desmethyltramadol;DESMETRAMADOL [INN];3-[(1R,2R)-2-[(DIMETHYLAMINO)METHYL]-1-HYDROXYCYCLOHEXYL]PHENOL;3-[(1R,2R)-2-[(dimethylamino)methyl]-1-hydroxy-cyclohexyl]phenol;Phenol, 3-((1R,2R)-2-((dimethylamino)methyl)-1-hydroxycyclohexyl)-;Phenol, 3-(2-((dimethylamino)methyl)-1-hydroxycyclohexyl)-, cis-(+/-)-;tramadol M1 metabolite;UWJUQVWARXYRCG-HIFRSBDPSA-N;NCGC00165941-01;AKOS030241093;DESMETRAMADOL [WHO-DD];3-{(1R,2R)-2-[(dimethylamino)methyl]-1-hydroxycyclohexyl}phenol;144830-14-8;Desmetramadol, cis-(+)-;O-Desmethyltramadol;SCHEMBL2517055;O-DESMETHYL TRAMADOL;3-((1R,2R)-2-((dimethylamino)methyl)-1-hydroxycyclohexyl)phenol;DTXSID901313651;(RR,SS)-3-(2-((DIMETHYLAMINO)METHYL)-1-HYDROXYCYCLOHEXYL)PHENOL;rel-3-((1R,2R)-2-((dimethylamino)methyl)-1-hydroxycyclohexyl)phenol;Desmetramadol;2WA8F50C3F;BDBM50176263;TRAMADOL HYDROCHLORIDE IMPURITY D [EP IMPURITY];BDBM50176258;Mono-O-demethyltramadol;CHEMBL1400;80456-81-1;PHENOL, 3-((1R,2R)-2-((DIMETHYLAMINO)METHYL)-1-HYDROXYCYCLOHEXYL)-, REL-;UNII-9W28LW2ET5;Q63395330;CHEBI:165221;DTXSID401044548;RAC-3-((1R,2R)-2-((DIMETHYLAMINO)METHYL)-1-HYDROXYCYCLOHEXYL)PHENOLC;NS00101143;CHEMBL201556;(-)-O-Desmethyl Tramadol (1.0mg/ml in Acetonitrile);3-[(1S,2S)-2-[(dimethylamino)methyl]-1-hydroxycyclohexyl]phenol;;

标识符

InChIKey:
UWJUQVWARXYRCG-HIFRSBDPSA-N
Inchi:
1S/C15H23NO2/c1-16(2)11-13-6-3-4-9-15(13,18)12-7-5-8-14(17)10-12/h5,7-8,10,13,17-18H,3-4,6,9,11H2,1-2H3/t13-,15+/m1/s1
SMILES:
O[C@]1(C2C=CC=C(C=2)O)CCCC[C@@H]1CN(C)C

Phenol,3-[(1R,2R)-2-[(dimethylamino)methyl]-1-hydroxycyclohexyl]-(144830-14-8)物化性质

实验特性

  • LogP : 2.33160
  • PSA : 43.70000

计算特性

  • 精确分子量 : 249.17300
  • 氢键供体数量 : 2
  • 氢键受体数量 : 3
  • 可旋转化学键数量 : 3
  • 同位素质量 : 249.172878976g/mol
  • 重原子数量 : 18
  • 复杂度 : 269
  • 同位素原子数量 : 0
  • 确定原子立构中心数量 : 2
  • 不确定原子立构中心数量 : 0
  • 确定化学键立构中心数量 : 0
  • 不确定化学键立构中心数量 : 0
  • 共价键单元数量 : 1
  • 疏水参数计算参考值(XlogP) : 2.3
  • 拓扑分子极性表面积 : 43.7Ų

Phenol,3-[(1R,2R)-2-[(dimethylamino)methyl]-1-hydroxycyclohexyl]-(144830-14-8)推荐厂家 更多厂家(4)

公司名称手机号/电话联系人QQ微信询单
上海甄准生物科技有限公司 13816009161
021-68920155
姜经理13816009161 3001086693
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上海维亦特生物科技有限公司 15317051735赵静 2033721411
询单
上海赛可锐生物科技有限公司 13003271654
021-58000709
赛可锐生物 3004122151
询单
上海赛可锐生物科技有限公司 13003271654
021-58000709
赛可锐生物 3004122151
询单

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