AB52614
1536473-72-9 | tBuBrettphos Pd G3
Manufacturer: A2B Chem
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CatalogNumber
AB52614
ChemicalName
tBuBrettphos Pd G3
CasNumber
1536473-72-9
MolecularFormula
C44H62NO5PPdS
MolecularWeight
854.4255410000007
MdlNumber
MFCD25976528
Smiles
COc1ccc(c(c1[P]([Pd+2]1([NH2]c2ccccc2C2=[C-]1C=CC=C2)[O-]S(=O)(=O)C)(C(C)(C)C)C(C)(C)C)c1c(cc(cc1C(C)C)C(C)C)C(C)C)OC
Complexity
1030
Covalently-bondedUnitCount
4
FormalCharge
-1
HeavyAtomCount
53
HydrogenBondAcceptorCount
7
HydrogenBondDonorCount
2
RotatableBondCount
10
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CatalogNumber: AB52614
ChemicalName: tBuBrettphos Pd G3
CasNumber: 1536473-72-9
MolecularFormula: C44H62NO5PPdS
MolecularWeight: 854.4255410000007
MdlNumber: MFCD25976528
Smiles: COc1ccc(c(c1[P]([Pd+2]1([NH2]c2ccccc2C2=[C-]1C=CC=C2)[O-]S(=O)(=O)C)(C(C)(C)C)C(C)(C)C)c1c(cc(cc1C(C)C)C(C)C)C(C)C)OC
Complexity: 1030
Covalently-bondedUnitCount: 4
FormalCharge: -1
HeavyAtomCount: 53
HydrogenBondAcceptorCount: 7
HydrogenBondDonorCount: 2
RotatableBondCount: 10
CatalogNumber:
AB52614
ChemicalName:
tBuBrettphos Pd G3
CasNumber:
1536473-72-9
MolecularFormula:
C44H62NO5PPdS
MolecularWeight:
854.4255410000007
MdlNumber:
MFCD25976528
Smiles:
COc1ccc(c(c1[P]([Pd+2]1([NH2]c2ccccc2C2=[C-]1C=CC=C2)[O-]S(=O)(=O)C)(C(C)(C)C)C(C)(C)C)c1c(cc(cc1C(C)C)C(C)C)C(C)C)OC
Complexity:
1030
Covalently-bondedUnitCount:
4
FormalCharge:
-1
HeavyAtomCount:
53
HydrogenBondAcceptorCount:
7
HydrogenBondDonorCount:
2
RotatableBondCount:
10
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: S=[Ge]=S
Complexity: 18.3
Covalently-bondedUnitCount: __
FormalCharge: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
HydrogenBondDonorCount: __
RotatableBondCount: __
CatalogNumber:
__
ChemicalName:
__
CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
__
Smiles:
S=[Ge]=S
Complexity:
18.3
Covalently-bondedUnitCount:
__
FormalCharge:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
HydrogenBondDonorCount:
__
RotatableBondCount:
__
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: C/C=C/C=C/C=C\CC/C=C/C(=O)NCC(C)C
Complexity: __
Covalently-bondedUnitCount: __
FormalCharge: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
HydrogenBondDonorCount: __
RotatableBondCount: __
CatalogNumber:
__
ChemicalName:
__
CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
__
Smiles:
C/C=C/C=C/C=C\CC/C=C/C(=O)NCC(C)C
Complexity:
__
Covalently-bondedUnitCount:
__
FormalCharge:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
HydrogenBondDonorCount:
__
RotatableBondCount:
__
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: Nc1nc(N)nc(n1)N.C=O
Complexity: __
Covalently-bondedUnitCount: __
FormalCharge: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
HydrogenBondDonorCount: __
RotatableBondCount: __
CatalogNumber:
__
ChemicalName:
__
CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
__
Smiles:
Nc1nc(N)nc(n1)N.C=O
Complexity:
__
Covalently-bondedUnitCount:
__
FormalCharge:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
HydrogenBondDonorCount:
__
RotatableBondCount:
__