AE10460
1072945-88-0 | 1-(3-Chlorophenyl)pyrazole-4-boronic acid
Manufacturer: A2B Chem
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CatalogNumber
AE10460
ChemicalName
1-(3-Chlorophenyl)pyrazole-4-boronic acid
CasNumber
1072945-88-0
MolecularFormula
C9H8BClN2O2
MolecularWeight
222.436
MdlNumber
MFCD09878353
Smiles
Clc1cccc(c1)n1ncc(c1)B(O)O
Complexity
220
Covalently-bondedUnitCount
1
HeavyAtomCount
15
HydrogenBondAcceptorCount
3
HydrogenBondDonorCount
2
RotatableBondCount
2
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CatalogNumber: AE10460
ChemicalName: 1-(3-Chlorophenyl)pyrazole-4-boronic acid
CasNumber: 1072945-88-0
MolecularFormula: C9H8BClN2O2
MolecularWeight: 222.436
MdlNumber: MFCD09878353
Smiles: Clc1cccc(c1)n1ncc(c1)B(O)O
Complexity: 220
Covalently-bondedUnitCount: 1
HeavyAtomCount: 15
HydrogenBondAcceptorCount: 3
HydrogenBondDonorCount: 2
RotatableBondCount: 2
CatalogNumber:
AE10460
ChemicalName:
1-(3-Chlorophenyl)pyrazole-4-boronic acid
CasNumber:
1072945-88-0
MolecularFormula:
C9H8BClN2O2
MolecularWeight:
222.436
MdlNumber:
MFCD09878353
Smiles:
Clc1cccc(c1)n1ncc(c1)B(O)O
Complexity:
220
Covalently-bondedUnitCount:
1
HeavyAtomCount:
15
HydrogenBondAcceptorCount:
3
HydrogenBondDonorCount:
2
RotatableBondCount:
2
CatalogNumber: AE10461
ChemicalName: 1-(5-Bromopyridin-2-yl)azepane
CasNumber: 1175900-46-5
MolecularFormula: C11H15BrN2
MolecularWeight: 255.1542
MdlNumber: MFCD11923073
Smiles: Brc1ccc(nc1)N1CCCCCC1
Complexity: 167
Covalently-bondedUnitCount: 1
HeavyAtomCount: 14
HydrogenBondAcceptorCount: 2
HydrogenBondDonorCount: __
RotatableBondCount: 1
CatalogNumber:
AE10461
ChemicalName:
1-(5-Bromopyridin-2-yl)azepane
CasNumber:
1175900-46-5
MolecularFormula:
C11H15BrN2
MolecularWeight:
255.1542
MdlNumber:
MFCD11923073
Smiles:
Brc1ccc(nc1)N1CCCCCC1
Complexity:
167
Covalently-bondedUnitCount:
1
HeavyAtomCount:
14
HydrogenBondAcceptorCount:
2
HydrogenBondDonorCount:
__
RotatableBondCount:
1
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: OC(=O)CSc1nnc(n1N)c1ccccc1
Complexity: __
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
HydrogenBondDonorCount: __
RotatableBondCount: __
CatalogNumber:
__
ChemicalName:
__
CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
__
Smiles:
OC(=O)CSc1nnc(n1N)c1ccccc1
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
HydrogenBondDonorCount:
__
RotatableBondCount:
__
CatalogNumber: AE10463
ChemicalName: 2-Picoline-5-boronic acid hydrate
CasNumber: 1072952-30-7
MolecularFormula: C6H10BNO3
MolecularWeight: 154.9595
MdlNumber: MFCD06657901
Smiles: Cc1ccc(cn1)B(O)O.O
Complexity: 110
Covalently-bondedUnitCount: 2
HeavyAtomCount: 11
HydrogenBondAcceptorCount: 4
HydrogenBondDonorCount: 3
RotatableBondCount: 1
CatalogNumber:
AE10463
ChemicalName:
2-Picoline-5-boronic acid hydrate
CasNumber:
1072952-30-7
MolecularFormula:
C6H10BNO3
MolecularWeight:
154.9595
MdlNumber:
MFCD06657901
Smiles:
Cc1ccc(cn1)B(O)O.O
Complexity:
110
Covalently-bondedUnitCount:
2
HeavyAtomCount:
11
HydrogenBondAcceptorCount:
4
HydrogenBondDonorCount:
3
RotatableBondCount:
1