AC77634
957065-83-7 | 3-Fluoro-2-methoxy-5-methylthiophenylboronic acid
Manufacturer: A2B Chem
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CatalogNumber
AC77634
ChemicalName
3-Fluoro-2-methoxy-5-methylthiophenylboronic acid
CasNumber
957065-83-7
MolecularFormula
C8H10BFO3S
MolecularWeight
216.0376
MdlNumber
MFCD09878322
Smiles
COc1c(F)cc(cc1B(O)O)SC
Complexity
184
Covalently-bondedUnitCount
1
HeavyAtomCount
14
HydrogenBondAcceptorCount
5
HydrogenBondDonorCount
2
RotatableBondCount
3
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CatalogNumber: AC77634
ChemicalName: 3-Fluoro-2-methoxy-5-methylthiophenylboronic acid
CasNumber: 957065-83-7
MolecularFormula: C8H10BFO3S
MolecularWeight: 216.0376
MdlNumber: MFCD09878322
Smiles: COc1c(F)cc(cc1B(O)O)SC
Complexity: 184
Covalently-bondedUnitCount: 1
HeavyAtomCount: 14
HydrogenBondAcceptorCount: 5
HydrogenBondDonorCount: 2
RotatableBondCount: 3
CatalogNumber:
AC77634
ChemicalName:
3-Fluoro-2-methoxy-5-methylthiophenylboronic acid
CasNumber:
957065-83-7
MolecularFormula:
C8H10BFO3S
MolecularWeight:
216.0376
MdlNumber:
MFCD09878322
Smiles:
COc1c(F)cc(cc1B(O)O)SC
Complexity:
184
Covalently-bondedUnitCount:
1
HeavyAtomCount:
14
HydrogenBondAcceptorCount:
5
HydrogenBondDonorCount:
2
RotatableBondCount:
3
CatalogNumber: __
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Smiles: COC(=O)CCc1c2C=C3N=C(C(=C3CCC(=O)OC)C)C=c3[nH]c(=CC4=NC(=Cc(c1C)[nH]2)C(=C4C=C)C)c(c3CO)C
Complexity: __
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Smiles:
COC(=O)CCc1c2C=C3N=C(C(=C3CCC(=O)OC)C)C=c3[nH]c(=CC4=NC(=Cc(c1C)[nH]2)C(=C4C=C)C)c(c3CO)C
Complexity:
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HydrogenBondDonorCount:
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RotatableBondCount:
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Smiles: CS(=O)(=O)O.NN=c1[nH][nH]c(=NN)c2c1cccc2
Complexity: __
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Smiles:
CS(=O)(=O)O.NN=c1[nH][nH]c(=NN)c2c1cccc2
Complexity:
__
Covalently-bondedUnitCount:
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HeavyAtomCount:
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Smiles: CC(CCOC(=O)CC1(O)CCCCC1)C
Complexity: __
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HydrogenBondAcceptorCount: __
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CatalogNumber:
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ChemicalName:
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CasNumber:
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MolecularFormula:
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MolecularWeight:
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Smiles:
CC(CCOC(=O)CC1(O)CCCCC1)C
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
HydrogenBondDonorCount:
__
RotatableBondCount:
__