AF88095
32822-84-7 | Methyl 3-hydroxy-4,5-dimethylthiophene-2-carboxylate
Manufacturer: A2B Chem
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CatalogNumber
AF88095
ChemicalName
Methyl 3-hydroxy-4,5-dimethylthiophene-2-carboxylate
CasNumber
32822-84-7
MolecularFormula
C8H10O3S
MolecularWeight
186.2282
MdlNumber
MFCD15071706
Smiles
COC(=O)c1sc(c(c1O)C)C
Complexity
183
Covalently-bondedUnitCount
1
HeavyAtomCount
12
HydrogenBondAcceptorCount
4
HydrogenBondDonorCount
1
RotatableBondCount
2
Xlogp3
2.7
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CatalogNumber: AF88095
ChemicalName: Methyl 3-hydroxy-4,5-dimethylthiophene-2-carboxylate
CasNumber: 32822-84-7
MolecularFormula: C8H10O3S
MolecularWeight: 186.2282
MdlNumber: MFCD15071706
Smiles: COC(=O)c1sc(c(c1O)C)C
Complexity: 183
Covalently-bondedUnitCount: 1
HeavyAtomCount: 12
HydrogenBondAcceptorCount: 4
HydrogenBondDonorCount: 1
RotatableBondCount: 2
Xlogp3: 2.7
CatalogNumber:
AF88095
ChemicalName:
Methyl 3-hydroxy-4,5-dimethylthiophene-2-carboxylate
CasNumber:
32822-84-7
MolecularFormula:
C8H10O3S
MolecularWeight:
186.2282
MdlNumber:
MFCD15071706
Smiles:
COC(=O)c1sc(c(c1O)C)C
Complexity:
183
Covalently-bondedUnitCount:
1
HeavyAtomCount:
12
HydrogenBondAcceptorCount:
4
HydrogenBondDonorCount:
1
RotatableBondCount:
2
Xlogp3:
2.7
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Smiles: CCOC(=O)c1n2cc(C)ccc2nc1C(F)(F)F
Complexity: __
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
HydrogenBondDonorCount: __
RotatableBondCount: __
Xlogp3: __
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__
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Smiles:
CCOC(=O)c1n2cc(C)ccc2nc1C(F)(F)F
Complexity:
__
Covalently-bondedUnitCount:
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HeavyAtomCount:
__
HydrogenBondAcceptorCount:
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HydrogenBondDonorCount:
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RotatableBondCount:
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ChemicalName: __
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Smiles: CC1=CC2=C(C=C1)[N+](=CC=C2)[O-]
Complexity: __
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HeavyAtomCount: __
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MolecularFormula:
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MolecularWeight:
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Smiles:
CC1=CC2=C(C=C1)[N+](=CC=C2)[O-]
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
HydrogenBondDonorCount:
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RotatableBondCount:
__
Xlogp3:
__
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ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: __
Complexity: __
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
HydrogenBondDonorCount: __
RotatableBondCount: __
Xlogp3: __
CatalogNumber:
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ChemicalName:
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CasNumber:
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MolecularFormula:
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MolecularWeight:
__
MdlNumber:
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Smiles:
__
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
HydrogenBondDonorCount:
__
RotatableBondCount:
__
Xlogp3:
__