AE84535
1445085-97-1 | Xantphos Pd G3
Manufacturer: A2B Chem
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CatalogNumber
AE84535
ChemicalName
Xantphos Pd G3
CasNumber
1445085-97-1
MolecularFormula
C52H45NO4P2PdS
MolecularWeight
948.3505220000006
MdlNumber
MFCD22572675
Smiles
CS(=O)(=O)[O-][Pd+2]1([NH2]c2ccccc2C2=[C-]1C=CC=C2)[P](c1cccc2c1Oc1c(cccc1C2(C)C)P(c1ccccc1)c1ccccc1)(c1ccccc1)c1ccccc1
Complexity
1180
Covalently-bondedUnitCount
4
FormalCharge
-1
HeavyAtomCount
61
HydrogenBondAcceptorCount
6
HydrogenBondDonorCount
2
RotatableBondCount
7
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CatalogNumber: AE84535
ChemicalName: Xantphos Pd G3
CasNumber: 1445085-97-1
MolecularFormula: C52H45NO4P2PdS
MolecularWeight: 948.3505220000006
MdlNumber: MFCD22572675
Smiles: CS(=O)(=O)[O-][Pd+2]1([NH2]c2ccccc2C2=[C-]1C=CC=C2)[P](c1cccc2c1Oc1c(cccc1C2(C)C)P(c1ccccc1)c1ccccc1)(c1ccccc1)c1ccccc1
Complexity: 1180
Covalently-bondedUnitCount: 4
FormalCharge: -1
HeavyAtomCount: 61
HydrogenBondAcceptorCount: 6
HydrogenBondDonorCount: 2
RotatableBondCount: 7
CatalogNumber:
AE84535
ChemicalName:
Xantphos Pd G3
CasNumber:
1445085-97-1
MolecularFormula:
C52H45NO4P2PdS
MolecularWeight:
948.3505220000006
MdlNumber:
MFCD22572675
Smiles:
CS(=O)(=O)[O-][Pd+2]1([NH2]c2ccccc2C2=[C-]1C=CC=C2)[P](c1cccc2c1Oc1c(cccc1C2(C)C)P(c1ccccc1)c1ccccc1)(c1ccccc1)c1ccccc1
Complexity:
1180
Covalently-bondedUnitCount:
4
FormalCharge:
-1
HeavyAtomCount:
61
HydrogenBondAcceptorCount:
6
HydrogenBondDonorCount:
2
RotatableBondCount:
7
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: CCOC(=O)c1ncc(c(c1C)Cl)C
Complexity: __
Covalently-bondedUnitCount: __
FormalCharge: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
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RotatableBondCount: __
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ChemicalName:
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CasNumber:
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MolecularFormula:
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Smiles:
CCOC(=O)c1ncc(c(c1C)Cl)C
Complexity:
__
Covalently-bondedUnitCount:
__
FormalCharge:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
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HydrogenBondDonorCount:
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RotatableBondCount:
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MolecularFormula: __
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Smiles: COC(=O)[C@H]1N[C@H](c2ccc3c(c2)OCO3)c2c(C1)c1ccccc1[nH]2
Complexity: __
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MolecularFormula:
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MdlNumber:
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Smiles:
COC(=O)[C@H]1N[C@H](c2ccc3c(c2)OCO3)c2c(C1)c1ccccc1[nH]2
Complexity:
__
Covalently-bondedUnitCount:
__
FormalCharge:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
HydrogenBondDonorCount:
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RotatableBondCount:
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ChemicalName: __
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MolecularFormula: __
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Smiles: CC1CNC(CN1CC=C)C
Complexity: __
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FormalCharge: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
HydrogenBondDonorCount: __
RotatableBondCount: __
CatalogNumber:
__
ChemicalName:
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CasNumber:
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MolecularFormula:
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MolecularWeight:
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MdlNumber:
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Smiles:
CC1CNC(CN1CC=C)C
Complexity:
__
Covalently-bondedUnitCount:
__
FormalCharge:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
HydrogenBondDonorCount:
__
RotatableBondCount:
__