PMK glycidic acid
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CAS Number 2167189-50-4
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Catalog Number io-406862
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Molecular Weight 222.1900
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SMILES
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1 | PMK glycidic acid |
2 | 5U8HXA92GM |
3 | DEA NO. 8525 |
4 | 3,4-MDP-2-P methyl glycidic acid |
5 | 2-Oxiranecarboxylic acid, 3-(1,3-benzodioxol-5-yl)-2-methyl- |
Molecular Formula | C11H10O5 |
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Canonical SMILES | |
Isomeric SMILES | |
Molecular Weight | 222.1900 |
InChIKey | HZXMIVDAWKVPKJ-UHFFFAOYSA-N |
InChI | InChI=1S/C11H10O5/c1-11(10(12)13)9(16-11)6-2-3-7-8(4-6)15-5-14-7/h2-4,9H,5H2,1H3,(H,12,13) |
XLogP | 1.0000 |
ExactMass | 222.0528 |
MonoisotopicMass | 222.0528 |
TPSA | 68.3000 |
Complexity | 317.0000 |
Charge | 0.0000 |
HBondDonorCount | 1 |
HBondAcceptorCount | 5 |
RotatableBondCount | 2 |
HeavyAtomCount | 16 |
IsotopeAtomCount | 0 |
AtomStereoCount | 2 |
DefinedAtomStereoCount | 0 |
UndefinedAtomStereoCount | 2 |
BondStereoCount | 0 |
DefinedBondStereoCount | 0 |
UndefinedBondStereoCount | 0 |
CovalentUnitCount | 1 |
PatentCount | 0 |
PatentFamilyCount | 0 |
LiteratureCount | 0 |