AB54963
1072946-57-6 | 3-(4-Carboethoxybutyl)phenylboronic acid
Manufacturer: A2B Chem
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CatalogNumber
AB54963
ChemicalName
3-(4-Carboethoxybutyl)phenylboronic acid
CasNumber
1072946-57-6
MolecularFormula
C13H19BO4
MolecularWeight
250.0986
MdlNumber
MFCD11053845
Smiles
CCOC(=O)CCCCc1cccc(c1)B(O)O
Complexity
245
Covalently-bondedUnitCount
1
HeavyAtomCount
18
HydrogenBondAcceptorCount
4
HydrogenBondDonorCount
2
RotatableBondCount
8
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CatalogNumber: AB54963
ChemicalName: 3-(4-Carboethoxybutyl)phenylboronic acid
CasNumber: 1072946-57-6
MolecularFormula: C13H19BO4
MolecularWeight: 250.0986
MdlNumber: MFCD11053845
Smiles: CCOC(=O)CCCCc1cccc(c1)B(O)O
Complexity: 245
Covalently-bondedUnitCount: 1
HeavyAtomCount: 18
HydrogenBondAcceptorCount: 4
HydrogenBondDonorCount: 2
RotatableBondCount: 8
CatalogNumber:
AB54963
ChemicalName:
3-(4-Carboethoxybutyl)phenylboronic acid
CasNumber:
1072946-57-6
MolecularFormula:
C13H19BO4
MolecularWeight:
250.0986
MdlNumber:
MFCD11053845
Smiles:
CCOC(=O)CCCCc1cccc(c1)B(O)O
Complexity:
245
Covalently-bondedUnitCount:
1
HeavyAtomCount:
18
HydrogenBondAcceptorCount:
4
HydrogenBondDonorCount:
2
RotatableBondCount:
8
CatalogNumber: AB54964
ChemicalName: 3-(Cyclohexylcarbamoyl)-4-fluorophenylboronic acid
CasNumber: 874219-24-6
MolecularFormula: C13H17BFNO3
MolecularWeight: 265.0884
MdlNumber: MFCD08235043
Smiles: OB(c1ccc(c(c1)C(=O)NC1CCCCC1)F)O
Complexity: 310
Covalently-bondedUnitCount: 1
HeavyAtomCount: 19
HydrogenBondAcceptorCount: 4
HydrogenBondDonorCount: 3
RotatableBondCount: 3
CatalogNumber:
AB54964
ChemicalName:
3-(Cyclohexylcarbamoyl)-4-fluorophenylboronic acid
CasNumber:
874219-24-6
MolecularFormula:
C13H17BFNO3
MolecularWeight:
265.0884
MdlNumber:
MFCD08235043
Smiles:
OB(c1ccc(c(c1)C(=O)NC1CCCCC1)F)O
Complexity:
310
Covalently-bondedUnitCount:
1
HeavyAtomCount:
19
HydrogenBondAcceptorCount:
4
HydrogenBondDonorCount:
3
RotatableBondCount:
3
CatalogNumber: AB54965
ChemicalName: 3-Ethylsulfinylphenylboronic acid
CasNumber: 1072952-07-8
MolecularFormula: C8H11BO3S
MolecularWeight: 198.0471
MdlNumber: MFCD03092933
Smiles: CCS(=O)c1cccc(c1)B(O)O
Complexity: 186
Covalently-bondedUnitCount: 1
HeavyAtomCount: 13
HydrogenBondAcceptorCount: 4
HydrogenBondDonorCount: 2
RotatableBondCount: 3
CatalogNumber:
AB54965
ChemicalName:
3-Ethylsulfinylphenylboronic acid
CasNumber:
1072952-07-8
MolecularFormula:
C8H11BO3S
MolecularWeight:
198.0471
MdlNumber:
MFCD03092933
Smiles:
CCS(=O)c1cccc(c1)B(O)O
Complexity:
186
Covalently-bondedUnitCount:
1
HeavyAtomCount:
13
HydrogenBondAcceptorCount:
4
HydrogenBondDonorCount:
2
RotatableBondCount:
3
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: OB(c1ccc(c(c1)C(=O)NC(C)(C)C)Cl)O
Complexity: 280
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
HydrogenBondDonorCount: __
RotatableBondCount: __
CatalogNumber:
__
ChemicalName:
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CasNumber:
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MolecularFormula:
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MolecularWeight:
__
MdlNumber:
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Smiles:
OB(c1ccc(c(c1)C(=O)NC(C)(C)C)Cl)O
Complexity:
280
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
HydrogenBondDonorCount:
__
RotatableBondCount:
__