AI03468
957060-74-1 | 4-(Neopentyloxysulfonyl)phenylboronic acid
Manufacturer: A2B Chem
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CatalogNumber
AI03468
ChemicalName
4-(Neopentyloxysulfonyl)phenylboronic acid
CasNumber
957060-74-1
MolecularFormula
C11H17BO5S
MolecularWeight
272.1257
MdlNumber
MFCD09027229
Smiles
OB(c1ccc(cc1)S(=O)(=O)OCC(C)(C)C)O
Complexity
347
Covalently-bondedUnitCount
1
HeavyAtomCount
18
HydrogenBondAcceptorCount
5
HydrogenBondDonorCount
2
RotatableBondCount
5
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CatalogNumber: AI03468
ChemicalName: 4-(Neopentyloxysulfonyl)phenylboronic acid
CasNumber: 957060-74-1
MolecularFormula: C11H17BO5S
MolecularWeight: 272.1257
MdlNumber: MFCD09027229
Smiles: OB(c1ccc(cc1)S(=O)(=O)OCC(C)(C)C)O
Complexity: 347
Covalently-bondedUnitCount: 1
HeavyAtomCount: 18
HydrogenBondAcceptorCount: 5
HydrogenBondDonorCount: 2
RotatableBondCount: 5
CatalogNumber:
AI03468
ChemicalName:
4-(Neopentyloxysulfonyl)phenylboronic acid
CasNumber:
957060-74-1
MolecularFormula:
C11H17BO5S
MolecularWeight:
272.1257
MdlNumber:
MFCD09027229
Smiles:
OB(c1ccc(cc1)S(=O)(=O)OCC(C)(C)C)O
Complexity:
347
Covalently-bondedUnitCount:
1
HeavyAtomCount:
18
HydrogenBondAcceptorCount:
5
HydrogenBondDonorCount:
2
RotatableBondCount:
5
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: CS(=O)(=O)N1CCN(CC1)Cc1cc2c(s1)c(nc(n2)c1cccc2c1cn[nH]2)N1CCOCC1
Complexity: 832
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
HydrogenBondDonorCount: __
RotatableBondCount: __
CatalogNumber:
__
ChemicalName:
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CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
__
Smiles:
CS(=O)(=O)N1CCN(CC1)Cc1cc2c(s1)c(nc(n2)c1cccc2c1cn[nH]2)N1CCOCC1
Complexity:
832
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
HydrogenBondDonorCount:
__
RotatableBondCount:
__
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: Clc1nc(C)nc(c1)n1cccn1
Complexity: __
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
HydrogenBondDonorCount: __
RotatableBondCount: __
CatalogNumber:
__
ChemicalName:
__
CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
__
Smiles:
Clc1nc(C)nc(c1)n1cccn1
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
HydrogenBondDonorCount:
__
RotatableBondCount:
__
CatalogNumber: AI03471
ChemicalName: 3-Chloromethylphenylboronic acid
CasNumber: 957035-15-3
MolecularFormula: C7H8BClO2
MolecularWeight: 170.40122000000002
MdlNumber: MFCD09475872
Smiles: ClCc1cccc(c1)B(O)O
Complexity: 121
Covalently-bondedUnitCount: 1
HeavyAtomCount: 11
HydrogenBondAcceptorCount: 2
HydrogenBondDonorCount: 2
RotatableBondCount: 2
CatalogNumber:
AI03471
ChemicalName:
3-Chloromethylphenylboronic acid
CasNumber:
957035-15-3
MolecularFormula:
C7H8BClO2
MolecularWeight:
170.40122000000002
MdlNumber:
MFCD09475872
Smiles:
ClCc1cccc(c1)B(O)O
Complexity:
121
Covalently-bondedUnitCount:
1
HeavyAtomCount:
11
HydrogenBondAcceptorCount:
2
HydrogenBondDonorCount:
2
RotatableBondCount:
2