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Vitamin B6 | 8059-24-3

Product Name:Vitamin B6

CAS No:8059-24-3
MF:C8H10NO5P
MW:231.14
CID:48099
PubChem ID:104817
Names and Identifiers
  • Vitamin B6
  • 5-((3AR,6S,6AS)-2-OXO-HEXAHYDRO-THIENO[3,4-D]IMIDAZOL-6-YL)-PENTANOIC ACID
  • BIOEPIDERM
  • BIOS H
  • (+)-BIOTIN
  • BIOTIN
  • BIOTIN, IMMOBILIZED ON DEXTRAN
  • BIOTIN, IMMOBILIZED ON DEXTRAN-LYSINE
  • BIOTINUM
  • BIOTIN(V-H)
  • CIS-HEXAHYDRO-2-OXO-1H-THIENE[3,4]IMIDAZOLE-4-VALERIC ACID
  • COENZYME R
  • D(+)-BIOTIN
  • D-BIOTIN
  • D-CIS-HEXAHYDRO-2-OXO-1H-THIENO[3,4-D]IMIDAZOLE-4-PENTANOIC ACID
  • FACTOR S
  • HEXAHYDRO-2-OXO-1H-THIENO[3,4-D]IMIDAZOLE-4-PENTANOIC ACID
  • PHOTOPROBE(R) BIOTIN
  • RONACARE(TM) BIOTIN PLUS
  • VITAMIN B7
  • VITAMIN H
  • (5-hydroxy-4,6-dimethylpyridin-3-yl)methyl phosphate
  • Pyridoxine HCL
  • 2,4-Dimethyl-5-(phosphonatooxymethyl)pyridin-3-ol
  • NS00020888
  • Vitamin B6,(S)
  • FT-0636608
  • Vitamin B 6
  • A19429
  • 8059-24-3
  • EINECS 232-503-8
  • AKOS015891944
  • InChIKey:RBCOYOYDYNXAFA-UHFFFAOYSA-L
  • Inchi:1S/C8H12NO5P/c1-5-7(4-14-15(11,12)13)3-9-6(2)8(5)10/h3,10H,4H2,1-2H3,(H2,11,12,13)/p-2
  • SMILES:O=P(OCC1=CN=C(C)C(O)=C1C)([O-])[O-]
Chemical and Physical Properties

Computed Properties

  • 精确分子量: 231.03000
  • 氢键供体数量: 1
  • 氢键受体数量: 6
  • 可旋转化学键数量: 2
  • 同位素质量: 231.02965942 g/mol
  • 重原子数量: 15
  • 复杂度: 244
  • 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): -0.9
  • 拓扑分子极性表面积: 106Ų
  • 分子量: 231.14

Experimental Properties

  • LogP: 1.88970
  • PSA: 115.35000
  • 沸点: 567.6±60.0 °C at 760 mmHg
  • 熔点: 231-233 °C(lit.)
  • 蒸气压: 25°C时0.0±1.6 mmHg
  • 闪点: 297.1±32.9 °C
  • 溶解度: H2O: 0.2 mg/mL Solubility increases with addition of 1 N NaOH.
  • 颜色与性状: 无色结晶粉末
  • 密度: No data available
Security Information
  • RTECS号:XJ9088200
  • WGK Germany:1
  • 安全说明:S24/25:防止皮肤和眼睛接触。
  • 危害声明:H303+H313+H333
  • 警示性声明:P264+P280+P305+P351+P338+P337+P313
  • 储存条件:2-8°C,4°C条件下存储,-4摄氏度存储更佳
  • 信号词:warning
  • FLUKA BRAND F CODES:8
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