64623-08-1 ((a-D-Ribofuranoside, methyl2,3-anhydro-, 4-nitrobenzoate (9CI))

CAS号:
64623-08-1
英文名称:
a-D-Ribofuranoside, methyl2,3-anhydro-, 4-nitrobenzoate (9CI)
分子式:
C13H16O3
分子量:
220.264344215393

a-D-Ribofuranoside, methyl2,3-anhydro-, 4-nitrobenzoate (9CI)(64623-08-1)名称与标识符

名称

英文别名:
a-D-Ribofuranoside, methyl2,3-anhydro-, 4-nitrobenzoate (9CI);2-methyl-3-oxo-3-(2,4,6-trimethylphenyl)propanoic acid;AC1L6SX1;methyl 4,6-O-benzylidene-2-O-methyl-3-O-[(4-methylphenyl)sulfonyl]hexopyranoside;NSC170221;

标识符

InChIKey:
BNXYGYJTTAFHEE-UHFFFAOYSA-N
Inchi:
1S/C13H16O3/c1-7-5-8(2)11(9(3)6-7)12(14)10(4)13(15)16/h5-6,10H,1-4H3,(H,15,16)
SMILES:
O=C(C(C(=O)O)C)C1C(C)=CC(C)=CC=1C

a-D-Ribofuranoside, methyl2,3-anhydro-, 4-nitrobenzoate (9CI)(64623-08-1)物化性质

实验特性

  • LogP : 1.41350
  • PSA : 103.11000

计算特性

  • 精确分子量 : 295.06900