AA65313
1470372-59-8 | Brettphos Pd(II) G3
Manufacturer: A2B Chem
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CatalogNumber
AA65313
ChemicalName
Brettphos Pd(II) G3
CasNumber
1470372-59-8
MolecularFormula
C48H67NO5PPdS
MolecularWeight
907.508
MdlNumber
MFCD22572666
Smiles
COc1ccc(c(c1P([Pd+2]1([NH2]c2ccccc2C2=[C-]1C=CC=C2)[O-]S(=O)(=O)C)(C1CCCCC1)C1CCCCC1)c1c(cc(cc1C(C)C)C(C)C)C(C)C)OC
Complexity
1090
Covalently-bondedUnitCount
4
FormalCharge
-1
HeavyAtomCount
57
HydrogenBondAcceptorCount
7
HydrogenBondDonorCount
2
RotatableBondCount
10
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CatalogNumber: AA65313
ChemicalName: Brettphos Pd(II) G3
CasNumber: 1470372-59-8
MolecularFormula: C48H67NO5PPdS
MolecularWeight: 907.508
MdlNumber: MFCD22572666
Smiles: COc1ccc(c(c1P([Pd+2]1([NH2]c2ccccc2C2=[C-]1C=CC=C2)[O-]S(=O)(=O)C)(C1CCCCC1)C1CCCCC1)c1c(cc(cc1C(C)C)C(C)C)C(C)C)OC
Complexity: 1090
Covalently-bondedUnitCount: 4
FormalCharge: -1
HeavyAtomCount: 57
HydrogenBondAcceptorCount: 7
HydrogenBondDonorCount: 2
RotatableBondCount: 10
CatalogNumber:
AA65313
ChemicalName:
Brettphos Pd(II) G3
CasNumber:
1470372-59-8
MolecularFormula:
C48H67NO5PPdS
MolecularWeight:
907.508
MdlNumber:
MFCD22572666
Smiles:
COc1ccc(c(c1P([Pd+2]1([NH2]c2ccccc2C2=[C-]1C=CC=C2)[O-]S(=O)(=O)C)(C1CCCCC1)C1CCCCC1)c1c(cc(cc1C(C)C)C(C)C)C(C)C)OC
Complexity:
1090
Covalently-bondedUnitCount:
4
FormalCharge:
-1
HeavyAtomCount:
57
HydrogenBondAcceptorCount:
7
HydrogenBondDonorCount:
2
RotatableBondCount:
10
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
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Smiles: ClC(=O)c1cc(n(c1C)C)C
Complexity: __
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FormalCharge: __
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RotatableBondCount: __
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CasNumber:
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Smiles:
ClC(=O)c1cc(n(c1C)C)C
Complexity:
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__
FormalCharge:
__
HeavyAtomCount:
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HydrogenBondAcceptorCount:
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Smiles: Nc1nc(N)c2c(n1)n(cn2)C[C@H](OCP(=O)(O)O)C
Complexity: __
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Smiles:
Nc1nc(N)c2c(n1)n(cn2)C[C@H](OCP(=O)(O)O)C
Complexity:
__
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FormalCharge:
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HeavyAtomCount:
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HydrogenBondAcceptorCount:
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HydrogenBondDonorCount:
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RotatableBondCount:
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Smiles: CC(=CC(=O)C)Nc1ccccc1
Complexity: __
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HeavyAtomCount: __
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CatalogNumber:
__
ChemicalName:
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CasNumber:
__
MolecularFormula:
__
MolecularWeight:
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MdlNumber:
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Smiles:
CC(=CC(=O)C)Nc1ccccc1
Complexity:
__
Covalently-bondedUnitCount:
__
FormalCharge:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
HydrogenBondDonorCount:
__
RotatableBondCount:
__