AB48018
871333-01-6 | 2-Methyl-5-(pyrrolidin-1-ylsulfonyl)phenylboronic acid
Manufacturer: A2B Chem
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CatalogNumber
AB48018
ChemicalName
2-Methyl-5-(pyrrolidin-1-ylsulfonyl)phenylboronic acid
CasNumber
871333-01-6
MolecularFormula
C11H16BNO4S
MolecularWeight
269.125
MdlNumber
MFCD08056365
Smiles
OB(c1cc(ccc1C)S(=O)(=O)N1CCCC1)O
Complexity
375
Covalently-bondedUnitCount
1
HeavyAtomCount
18
HydrogenBondAcceptorCount
5
HydrogenBondDonorCount
2
RotatableBondCount
3
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CatalogNumber: AB48018
ChemicalName: 2-Methyl-5-(pyrrolidin-1-ylsulfonyl)phenylboronic acid
CasNumber: 871333-01-6
MolecularFormula: C11H16BNO4S
MolecularWeight: 269.125
MdlNumber: MFCD08056365
Smiles: OB(c1cc(ccc1C)S(=O)(=O)N1CCCC1)O
Complexity: 375
Covalently-bondedUnitCount: 1
HeavyAtomCount: 18
HydrogenBondAcceptorCount: 5
HydrogenBondDonorCount: 2
RotatableBondCount: 3
CatalogNumber:
AB48018
ChemicalName:
2-Methyl-5-(pyrrolidin-1-ylsulfonyl)phenylboronic acid
CasNumber:
871333-01-6
MolecularFormula:
C11H16BNO4S
MolecularWeight:
269.125
MdlNumber:
MFCD08056365
Smiles:
OB(c1cc(ccc1C)S(=O)(=O)N1CCCC1)O
Complexity:
375
Covalently-bondedUnitCount:
1
HeavyAtomCount:
18
HydrogenBondAcceptorCount:
5
HydrogenBondDonorCount:
2
RotatableBondCount:
3
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: COC(=O)c1nc(Br)ccc1N
Complexity: __
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
HydrogenBondDonorCount: __
RotatableBondCount: __
CatalogNumber:
__
ChemicalName:
__
CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
__
Smiles:
COC(=O)c1nc(Br)ccc1N
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
HydrogenBondDonorCount:
__
RotatableBondCount:
__
CatalogNumber: AB48020
ChemicalName: 1-Benzyl-1H-imidazole-5-carboxaldehyde
CasNumber: 85102-99-4
MolecularFormula: C11H10N2O
MolecularWeight: 186.2099
MdlNumber: MFCD02179539
Smiles: O=Cc1cncn1Cc1ccccc1
Complexity: 190
Covalently-bondedUnitCount: 1
HeavyAtomCount: 14
HydrogenBondAcceptorCount: 2
HydrogenBondDonorCount: __
RotatableBondCount: 3
CatalogNumber:
AB48020
ChemicalName:
1-Benzyl-1H-imidazole-5-carboxaldehyde
CasNumber:
85102-99-4
MolecularFormula:
C11H10N2O
MolecularWeight:
186.2099
MdlNumber:
MFCD02179539
Smiles:
O=Cc1cncn1Cc1ccccc1
Complexity:
190
Covalently-bondedUnitCount:
1
HeavyAtomCount:
14
HydrogenBondAcceptorCount:
2
HydrogenBondDonorCount:
__
RotatableBondCount:
3
CatalogNumber: AB48021
ChemicalName: N,N-Dimethyl-3-[4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)-1h-pyrazol-1-yl]-1-propanamine
CasNumber: 847818-72-8
MolecularFormula: C14H26BN3O2
MolecularWeight: 279.1861
MdlNumber: MFCD11983295
Smiles: CN(CCCn1ncc(c1)B1OC(C(O1)(C)C)(C)C)C
Complexity: 320
Covalently-bondedUnitCount: 1
HeavyAtomCount: 20
HydrogenBondAcceptorCount: 4
HydrogenBondDonorCount: __
RotatableBondCount: 5
CatalogNumber:
AB48021
ChemicalName:
N,N-Dimethyl-3-[4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)-1h-pyrazol-1-yl]-1-propanamine
CasNumber:
847818-72-8
MolecularFormula:
C14H26BN3O2
MolecularWeight:
279.1861
MdlNumber:
MFCD11983295
Smiles:
CN(CCCn1ncc(c1)B1OC(C(O1)(C)C)(C)C)C
Complexity:
320
Covalently-bondedUnitCount:
1
HeavyAtomCount:
20
HydrogenBondAcceptorCount:
4
HydrogenBondDonorCount:
__
RotatableBondCount:
5