AI08664
1112210-59-9 | 3-Chloro-5-hydroxymethylphenylboronic acid, pinacol ester
Manufacturer: A2B Chem
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CatalogNumber
AI08664
ChemicalName
3-Chloro-5-hydroxymethylphenylboronic acid, pinacol ester
CasNumber
1112210-59-9
MolecularFormula
C13H18BClO3
MolecularWeight
268.5442
MdlNumber
MFCD18374004
Smiles
OCc1cc(Cl)cc(c1)B1OC(C(O1)(C)C)(C)C
Complexity
293
Covalently-bondedUnitCount
1
HeavyAtomCount
18
HydrogenBondAcceptorCount
3
HydrogenBondDonorCount
1
RotatableBondCount
2
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CatalogNumber: AI08664
ChemicalName: 3-Chloro-5-hydroxymethylphenylboronic acid, pinacol ester
CasNumber: 1112210-59-9
MolecularFormula: C13H18BClO3
MolecularWeight: 268.5442
MdlNumber: MFCD18374004
Smiles: OCc1cc(Cl)cc(c1)B1OC(C(O1)(C)C)(C)C
Complexity: 293
Covalently-bondedUnitCount: 1
HeavyAtomCount: 18
HydrogenBondAcceptorCount: 3
HydrogenBondDonorCount: 1
RotatableBondCount: 2
CatalogNumber:
AI08664
ChemicalName:
3-Chloro-5-hydroxymethylphenylboronic acid, pinacol ester
CasNumber:
1112210-59-9
MolecularFormula:
C13H18BClO3
MolecularWeight:
268.5442
MdlNumber:
MFCD18374004
Smiles:
OCc1cc(Cl)cc(c1)B1OC(C(O1)(C)C)(C)C
Complexity:
293
Covalently-bondedUnitCount:
1
HeavyAtomCount:
18
HydrogenBondAcceptorCount:
3
HydrogenBondDonorCount:
1
RotatableBondCount:
2
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
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Smiles: COC(=O)C(=O)/C=C/c1cccc(c1)Cl
Complexity: __
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
HydrogenBondDonorCount: __
RotatableBondCount: __
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CasNumber:
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MdlNumber:
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Smiles:
COC(=O)C(=O)/C=C/c1cccc(c1)Cl
Complexity:
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Covalently-bondedUnitCount:
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HeavyAtomCount:
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HydrogenBondAcceptorCount:
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HydrogenBondDonorCount:
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RotatableBondCount:
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Smiles: Clc1cc(c(c(c1)S(=O)(=O)Cl)Cl)S(=O)(=O)Cl
Complexity: __
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CasNumber:
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MolecularFormula:
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MolecularWeight:
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Smiles:
Clc1cc(c(c(c1)S(=O)(=O)Cl)Cl)S(=O)(=O)Cl
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
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HydrogenBondAcceptorCount:
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HydrogenBondDonorCount:
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RotatableBondCount:
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Smiles: C1=NNC(=C(C1=O)Cl)Cl
Complexity: __
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HeavyAtomCount: __
HydrogenBondAcceptorCount: __
HydrogenBondDonorCount: __
RotatableBondCount: __
CatalogNumber:
__
ChemicalName:
__
CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
__
Smiles:
C1=NNC(=C(C1=O)Cl)Cl
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
HydrogenBondDonorCount:
__
RotatableBondCount:
__