AB52612
7019-01-4 | 4-(Phenylsulfonyl)aniline
Manufacturer: A2B Chem
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CatalogNumber
AB52612
ChemicalName
4-(Phenylsulfonyl)aniline
CasNumber
7019-01-4
MolecularFormula
C12H11NO2S
MolecularWeight
233.2862
MdlNumber
MFCD00625703
Smiles
Nc1ccc(cc1)S(=O)(=O)c1ccccc1
Complexity
306
Covalently-bondedUnitCount
1
HeavyAtomCount
16
HydrogenBondAcceptorCount
3
HydrogenBondDonorCount
1
RotatableBondCount
2
Xlogp3
1.8
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CatalogNumber: AB52612
ChemicalName: 4-(Phenylsulfonyl)aniline
CasNumber: 7019-01-4
MolecularFormula: C12H11NO2S
MolecularWeight: 233.2862
MdlNumber: MFCD00625703
Smiles: Nc1ccc(cc1)S(=O)(=O)c1ccccc1
Complexity: 306
Covalently-bondedUnitCount: 1
HeavyAtomCount: 16
HydrogenBondAcceptorCount: 3
HydrogenBondDonorCount: 1
RotatableBondCount: 2
Xlogp3: 1.8
CatalogNumber:
AB52612
ChemicalName:
4-(Phenylsulfonyl)aniline
CasNumber:
7019-01-4
MolecularFormula:
C12H11NO2S
MolecularWeight:
233.2862
MdlNumber:
MFCD00625703
Smiles:
Nc1ccc(cc1)S(=O)(=O)c1ccccc1
Complexity:
306
Covalently-bondedUnitCount:
1
HeavyAtomCount:
16
HydrogenBondAcceptorCount:
3
HydrogenBondDonorCount:
1
RotatableBondCount:
2
Xlogp3:
1.8
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: CC(P(C1CCCCC1)C1CCCCC1)(C)C
Complexity: __
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
HydrogenBondDonorCount: __
RotatableBondCount: __
Xlogp3: __
CatalogNumber:
__
ChemicalName:
__
CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
__
Smiles:
CC(P(C1CCCCC1)C1CCCCC1)(C)C
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
HydrogenBondDonorCount:
__
RotatableBondCount:
__
Xlogp3:
__
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
HeavyAtomCount: 53
HydrogenBondAcceptorCount: 7
HydrogenBondDonorCount: 2
RotatableBondCount: 10
Xlogp3: __
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
HeavyAtomCount:
53
HydrogenBondAcceptorCount:
7
HydrogenBondDonorCount:
2
RotatableBondCount:
10
Xlogp3:
__
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: S=[Ge]=S
Complexity: 18.3
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
HydrogenBondDonorCount: __
RotatableBondCount: __
Xlogp3: __
CatalogNumber:
__
ChemicalName:
__
CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
__
Smiles:
S=[Ge]=S
Complexity:
18.3
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
HydrogenBondDonorCount:
__
RotatableBondCount:
__
Xlogp3:
__