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28993-44-4 | 1,4-Benzodioxin-2,3-diol, 2,3-dihydro-
CAS No: 28993-44-4 Catalog No: AG002V5K MDL No:MFCD00182791
Product Description
Catalog Number:
AG002V5K
Chemical Name:
1,4-Benzodioxin-2,3-diol, 2,3-dihydro-
CAS Number:
28993-44-4
Molecular Formula:
C8H8O4
Molecular Weight:
168.1467
MDL Number:
MFCD00182791
IUPAC Name:
2,3-dihydro-1,4-benzodioxine-2,3-diol
InChI:
InChI=1S/C8H8O4/c9-7-8(10)12-6-4-2-1-3-5(6)11-7/h1-4,7-10H
InChI Key:
OXKPADVJDHHVHQ-UHFFFAOYSA-N
SMILES:
OC1Oc2ccccc2OC1O
Properties
Complexity:
143
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
168.042g/mol
Formal Charge:
0
Heavy Atom Count:
12
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
168.148g/mol
Monoisotopic Mass:
168.042g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
58.9A^2
Undefined Atom Stereocenter Count:
2
Undefined Bond Stereocenter Count:
0
XLogP3:
0.6
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