22105-09-5 (4H-1-苯并吡喃-4-酮,2-羟基-,4H-1-Benzopyran-4-one,2-hydroxy-)

CAS号:
22105-09-5
中文名称:
4H-1-苯并吡喃-4-酮,2-羟基-
英文名称:
4H-1-Benzopyran-4-one,2-hydroxy-
分子式:
C9H6O3
分子量:
162.142142772675

4H-1-苯并吡喃-4-酮,2-羟基-(22105-09-5)名称与标识符

名称

英文别名:
4H-1-Benzopyran-4-one,2-hydroxy-;4-hydroxychromen-2-one;2-Hydroxychromone;Chromone,2-hydroxy- (6CI,8CI);J-515519;CHEBI:40070;CBiol_000838;DTXSID8061472;4-Coumarinol;AM84328;4-Hydroxy-chromen-2-one;FT-0602218;4-HYDROXY-1-BENZOPYRAN-2-ONE;SMR000112320;4-Hydroxy-2H-1-benzopyran-2-one (4-Hydroxycoumarin);2-Hydroxy-4H-1-benzopyran-4-one;MEGxm0_000452;MFCD00006856;DTXSID50944748;Z56922074;4-hydroxy-2-oxo-2H-1-benzopyran;BRN 0129768;Q25323691;4-Hydroxy-2H-chromen-2-one;4-hydroxy-2H-benzo[b]pyran-2-one;NCGC00179970-01;hydroxychromone;4-Monohydroxycoumarin;PD016118;ICCB4_000134;5-18-01-00378 (Beilstein Handbook Reference);4H-1-Benzopyran-4-one, 2-hydroxy-;AI3-52393;SCHEMBL131312;AKOS037515220;1076-38-6;HY-N6856;C20414;F0266-2972;SY001614;NSC 11889;BCP31120;X954ZLL2RD;BRD-K48844111-001-01-4;WARFARIN SODIUM IMPURITY B [EP IMPURITY];4-hydroxy-coumarin;FT-0660645;4-hyroxycoumarin;4-HYDROXYCOUMARIN [USP IMPURITY];4-Hydroxy-2H-1-benzopyran-2-one;SR-01000389319-1;Benzotetronic acid;J-620003;4HC;4-Hydroxy-2H-chromen-2-one #;STR01861;WLN: T66 BOVJ EQ;SCHEMBL1961365;HMS1607G02;4- Hydroxycoumarin;4-Hydroxycoumarin, Vetec(TM) reagent grade, 98%;NSC-11889;DB03410;NCI60_000453;EINECS 214-060-2;AC-13227;H0235;NS00014742;ACon1_001952;4hydroxycoumarin;4-Hydroxycoumarin, 98%;4-Hydroxy Coumarin;4-Coumarinol;4-Hydroxy-2H-chromen-2-one;AKOS000119142;EN300-17333;4-Hydroxy coumarin;CS-0015925;BDBM50055710;4-HYDROXY-1-BENZOPYRAN-2-ONE; 4-HYDROXYCOUMARIN;InChI=1/C9H6O3/c10-7-5-9(11)12-8-4-2-1-3-6(7)8/h1-5,10;SR-01000389319;CHEMBL301141;D71127;UNII-X954ZLL2RD;2H-1-BENZOPYRAN-2-ONE, 4-HYDROXY-;4-hydroxy-2-chromenone;22105-09-5;4-hydroxyl coumarin;NSC11889;4-Hydroxycoumarin;MLS004491719;BB 0220623;Coumarin, 4-hydroxy-;EU-0066799;4-Hydroxycoumarine;4-Hydroxy-1-benzopyran-2-one; 4-Coumarinyl alcohol;BBL027616;STK801816;DB-014485;AH-034/32464035;

标识符

InChIKey:
VXIXUWQIVKSKSA-UHFFFAOYSA-N
Inchi:
1S/C9H6O3/c10-7-5-9(11)12-8-4-2-1-3-6(7)8/h1-5,10H
SMILES:
O1C(C=C(C2C=CC=CC1=2)O)=O

4H-1-苯并吡喃-4-酮,2-羟基-(22105-09-5)物化性质

实验特性

  • PSA : 46.53

计算特性

  • 精确分子量 : 162.03168
  • 氢键供体数量 : 1
  • 氢键受体数量 : 3
  • 可旋转化学键数量 : 0
  • 同位素质量 : 162.031694
  • 重原子数量 : 12
  • 复杂度 : 232
  • 同位素原子数量 : 0
  • 确定原子立构中心数量 : 0
  • 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) : 1.7
  • 拓扑分子极性表面积 : 46.5

4H-1-苯并吡喃-4-酮,2-羟基-(22105-09-5)推荐厂家 更多厂家(1)

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