AX54969
2096338-19-9 | 4-Pyrrolidinosulfonyl-2-trifluoromethylphenylboronic acid
Manufacturer: A2B Chem
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CatalogNumber
AX54969
ChemicalName
4-Pyrrolidinosulfonyl-2-trifluoromethylphenylboronic acid
CasNumber
2096338-19-9
MolecularFormula
C11H13BF3NO4S
MolecularWeight
323.0964
MdlNumber
MFCD19981518
Smiles
OB(c1ccc(cc1C(F)(F)F)S(=O)(=O)N1CCCC1)O
Complexity
459
Covalently-bondedUnitCount
1
HeavyAtomCount
21
HydrogenBondAcceptorCount
8
HydrogenBondDonorCount
2
RotatableBondCount
3
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CatalogNumber: AX54969
ChemicalName: 4-Pyrrolidinosulfonyl-2-trifluoromethylphenylboronic acid
CasNumber: 2096338-19-9
MolecularFormula: C11H13BF3NO4S
MolecularWeight: 323.0964
MdlNumber: MFCD19981518
Smiles: OB(c1ccc(cc1C(F)(F)F)S(=O)(=O)N1CCCC1)O
Complexity: 459
Covalently-bondedUnitCount: 1
HeavyAtomCount: 21
HydrogenBondAcceptorCount: 8
HydrogenBondDonorCount: 2
RotatableBondCount: 3
CatalogNumber:
AX54969
ChemicalName:
4-Pyrrolidinosulfonyl-2-trifluoromethylphenylboronic acid
CasNumber:
2096338-19-9
MolecularFormula:
C11H13BF3NO4S
MolecularWeight:
323.0964
MdlNumber:
MFCD19981518
Smiles:
OB(c1ccc(cc1C(F)(F)F)S(=O)(=O)N1CCCC1)O
Complexity:
459
Covalently-bondedUnitCount:
1
HeavyAtomCount:
21
HydrogenBondAcceptorCount:
8
HydrogenBondDonorCount:
2
RotatableBondCount:
3
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: COC(=O)c1ccc(cc1)CS(=O)(=O)NC1CC1
Complexity: 389
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
HydrogenBondDonorCount: __
RotatableBondCount: __
CatalogNumber:
__
ChemicalName:
__
CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
__
Smiles:
COC(=O)c1ccc(cc1)CS(=O)(=O)NC1CC1
Complexity:
389
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
HydrogenBondDonorCount:
__
RotatableBondCount:
__
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: CC1(C)OB(OC1(C)C)c1cc(OC2CCOCC2)cc(c1)C(F)(F)F
Complexity: 475
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
HydrogenBondDonorCount: __
RotatableBondCount: __
CatalogNumber:
__
ChemicalName:
__
CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
__
Smiles:
CC1(C)OB(OC1(C)C)c1cc(OC2CCOCC2)cc(c1)C(F)(F)F
Complexity:
475
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
HydrogenBondDonorCount:
__
RotatableBondCount:
__
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: __
Complexity: __
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
HydrogenBondDonorCount: __
RotatableBondCount: __
CatalogNumber:
__
ChemicalName:
__
CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
__
Smiles:
__
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
HydrogenBondDonorCount:
__
RotatableBondCount:
__