34214-51-2 (氟氯西林钠水合物,Floxacillin sodium hydrate)

CAS号:
34214-51-2
中文名称:
氟氯西林钠水合物
英文名称:
Floxacillin sodium hydrate
分子式:
C19H18ClFN3NaO6S
分子量:
493.87

氟氯西林钠水合物(34214-51-2)名称与标识符

名称

中文别名:
氟氯西林钠;氟氯西林钠 标准品;氟氯西林钠水合物;
英文别名:
4-Thia-1-azabicyclo[3.2.0]heptane-2-carboxylicacid,6-[[[3-(2-chloro-6-fluorophenyl)-5-methyl-4-isoxazolyl]carbonyl]amino]-3,3-dimethyl-7-oxo-,monosodium salt, monohydrate, (2S,5R,6R)- (9CI);sodium,(2S,5R,6R)-6-[[3-(2-chloro-6-fluorophenyl)-5-methyl-1,2-oxazole-4-carbonyl]amino]-3,3-dimethyl-7-oxo-4-thia-1-azabicyclo[3.2.0]heptane-2-carboxylate,hydrate;4-Thia-1-azabicyclo[3.2.0]heptane-2-carboxylicacid,6-[[[3-(2-chloro-6-fluorophenyl)-5-methyl-4-isoxazolyl]carbonyl]amino]-3,3-dimethyl-7-oxo-,monosodium salt, monohydrate, [2S-(2a,5a,6b)]-;4-Thia-1-azabicyclo[3.2.0]heptane-2-carboxylicacid,6-[3-(2-chloro-6-fluorophenyl)-5-methyl-4-isoxazolecarboxamido]-3,3-dimethyl-7-oxo-,monosodium salt, monohydrate (8CI);Sodium flucloxacillinmonohydrate;3-(2-Chloro-6-fluorophenyl)-5-methyl-4-isoxazolylpenicillin sodium monohydrate;flucloxacillin sodium;ABBOFLOX;4-THIA-1-AZABICYCLO(3.2.0)HEPTANE-2-CARBOXYLIC ACID, 6-(((3-(2-CHLORO-6-FLUOROPHENYL)-5-METHYL-4-ISOXAZOLYL)CARBONYL)AMINO)-3,3-DIMETHYL-7-OXO-, SODIUM SALT MONOHYDRATE (2S(2.ALPHA.,5.ALPHA.,6.BETA.));Staphcil;Ladropen;34214-51-2;Stafoxil;4-Thia-1-azabicyclo(3.2.0)heptane-2-carboxylic acid, 6-(3-(2-chloro-6-fluorophenyl)-5-methyl-4-isoxazolecarboxamido)-3,3-dimethyl-7-oxo-, sodium salt, monohydrate;Floxapen;LMG7C674WJ;FLUCLOXACILLIN SODIUM MONOHYDRATE [MI];DTXCID9026477;NCGC00164609-01;6-(3-(2-Chloro-6-fluorophenyl)-5-methyl-4-isoxazolecarboxamido)penicillanic acid sodium salt;Floxacillin sodium hydrate;FLUCLOXACILLIN SODIUM [EP MONOGRAPH];CAS-34214-51-2;DTXSID1046477;Culpen;D01249;FLOXACILLIN SODIUM MONOHYDRATE;sodium 6beta-{[3-(2-chloro-6-fluorophenyl)-5-methyl-1,2-oxazol-4-yl]carboxamido}-2,2-dimethylpenam-3alpha-carboxylate--water (1/1);AKOS015962880;AC-18975;UNII-LMG7C674WJ;Flucloxacillin sodium hydrate;SODIUM (2S,5R,6R)-6-(((3-(2-CHLORO-6-FLUOROPHENYL)-5-METHYLISOXAZOL-4-YL)CARBONYL)AMINO)-3,3-DIMETHYL-7-OXO-4-THIA-1-AZABICYCLO(3.2.0)HEPTANE-2-CARBOXYLATE MONOHYDRATE;STAPHLIPEN;Q27123122;Tox21_112230;Staphylex;CHEMBL3187256;sodium;(2S,5R,6R)-6-[[3-(2-chloro-6-fluorophenyl)-5-methyl-1,2-oxazole-4-carbonyl]amino]-3,3-dimethyl-7-oxo-4-thia-1-azabicyclo[3.2.0]heptane-2-carboxylate;hydrate;sodium (2S,5R,6R)-6-({[3-(2-chloro-6-fluorophenyl)-5-methyl-1,2-oxazol-4-yl]carbonyl}amino)-3,3-dimethyl-7-oxo-4-thia-1-azabicyclo[3.2.0]heptane-2-carboxylate hydrate;Flucloxacillin sodium (JAN);Flucloxacillin sodium [JAN];Flucloxacillin sodium monohydrate;Floxapen (TN);CHEBI:52040;floxacillinsodium;

标识符

InChIKey:
PARMJFIQRZRMHG-VICXVTCVSA-M
Inchi:
1S/C19H17ClFN3O5S.Na.H2O/c1-7-10(12(23-29-7)11-8(20)5-4-6-9(11)21)15(25)22-13-16(26)24-14(18(27)28)19(2,3)30-17(13)24;;/h4-6,13-14,17H,1-3H3,(H,22,25)(H,27,28);;1H2/q;+1;/p-1/t13-,14+,17-;;/m1../s1
SMILES:
ClC1C=CC=C(C=1C1C(=C(C)ON=1)C(N[C@@H]1C(N2[C@@H](C(=O)[O-])C(C)(C)S[C@@H]21)=O)=O)F.[Na+].O

氟氯西林钠水合物(34214-51-2)物化性质

实验特性

  • 沸点 : 677.3°Cat760mmHg
  • 闪点 : 363.4°C
  • 密度 : 1.59

计算特性

  • 精确分子量 : 493.049
  • 氢键供体数量 : 2
  • 氢键受体数量 : 9
  • 可旋转化学键数量 : 4
  • 同位素质量 : 493.049
  • 重原子数量 : 32
  • 复杂度 : 764
  • 同位素原子数量 : 0
  • 确定原子立构中心数量 : 3
  • 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 : 3
  • 拓扑分子极性表面积 : 142A^2

氟氯西林钠水合物(34214-51-2)安全信息

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