AG32815
53059-30-6 | 4-(3-Nitrophenyl)phenol
Manufacturer: A2B Chem
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CatalogNumber
AG32815
ChemicalName
4-(3-Nitrophenyl)phenol
CasNumber
53059-30-6
MolecularFormula
C12H9NO3
MolecularWeight
215.2048
MdlNumber
MFCD09909462
Smiles
Oc1ccc(cc1)c1cccc(c1)[N+](=O)[O-]
Complexity
243
Covalently-bondedUnitCount
1
HeavyAtomCount
16
HydrogenBondAcceptorCount
3
HydrogenBondDonorCount
1
RotatableBondCount
1
Xlogp3
3.5
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CatalogNumber: AG32815
ChemicalName: 4-(3-Nitrophenyl)phenol
CasNumber: 53059-30-6
MolecularFormula: C12H9NO3
MolecularWeight: 215.2048
MdlNumber: MFCD09909462
Smiles: Oc1ccc(cc1)c1cccc(c1)[N+](=O)[O-]
Complexity: 243
Covalently-bondedUnitCount: 1
HeavyAtomCount: 16
HydrogenBondAcceptorCount: 3
HydrogenBondDonorCount: 1
RotatableBondCount: 1
Xlogp3: 3.5
CatalogNumber:
AG32815
ChemicalName:
4-(3-Nitrophenyl)phenol
CasNumber:
53059-30-6
MolecularFormula:
C12H9NO3
MolecularWeight:
215.2048
MdlNumber:
MFCD09909462
Smiles:
Oc1ccc(cc1)c1cccc(c1)[N+](=O)[O-]
Complexity:
243
Covalently-bondedUnitCount:
1
HeavyAtomCount:
16
HydrogenBondAcceptorCount:
3
HydrogenBondDonorCount:
1
RotatableBondCount:
1
Xlogp3:
3.5
CatalogNumber: AG32816
ChemicalName: 5-Bromo-2-(dimethylamino)benzonitrile
CasNumber: 501086-59-5
MolecularFormula: C9H9BrN2
MolecularWeight: 225.08515999999997
MdlNumber: MFCD21609719
Smiles: N#Cc1cc(Br)ccc1N(C)C
Complexity: 194
Covalently-bondedUnitCount: 1
HeavyAtomCount: 12
HydrogenBondAcceptorCount: 2
HydrogenBondDonorCount: __
RotatableBondCount: 1
Xlogp3: 2.5
CatalogNumber:
AG32816
ChemicalName:
5-Bromo-2-(dimethylamino)benzonitrile
CasNumber:
501086-59-5
MolecularFormula:
C9H9BrN2
MolecularWeight:
225.08515999999997
MdlNumber:
MFCD21609719
Smiles:
N#Cc1cc(Br)ccc1N(C)C
Complexity:
194
Covalently-bondedUnitCount:
1
HeavyAtomCount:
12
HydrogenBondAcceptorCount:
2
HydrogenBondDonorCount:
__
RotatableBondCount:
1
Xlogp3:
2.5
CatalogNumber: AG32817
ChemicalName: 4-Bromobenzenesulfonyl fluoride
CasNumber: 498-83-9
MolecularFormula: C6H4BrFO2S
MolecularWeight: 239.0622
MdlNumber: MFCD21892326
Smiles: Brc1ccc(cc1)S(=O)(=O)F
Complexity: 213
Covalently-bondedUnitCount: 1
HeavyAtomCount: 11
HydrogenBondAcceptorCount: 3
HydrogenBondDonorCount: __
RotatableBondCount: 1
Xlogp3: 2.6
CatalogNumber:
AG32817
ChemicalName:
4-Bromobenzenesulfonyl fluoride
CasNumber:
498-83-9
MolecularFormula:
C6H4BrFO2S
MolecularWeight:
239.0622
MdlNumber:
MFCD21892326
Smiles:
Brc1ccc(cc1)S(=O)(=O)F
Complexity:
213
Covalently-bondedUnitCount:
1
HeavyAtomCount:
11
HydrogenBondAcceptorCount:
3
HydrogenBondDonorCount:
__
RotatableBondCount:
1
Xlogp3:
2.6
CatalogNumber: AG32818
ChemicalName: 3-[(3-Methoxypropyl)sulfamoyl]benzoic acid
CasNumber: 500292-39-7
MolecularFormula: C11H15NO5S
MolecularWeight: 273.3055
MdlNumber: MFCD08337775
Smiles: COCCCNS(=O)(=O)c1cccc(c1)C(=O)O
Complexity: 362
Covalently-bondedUnitCount: 1
HeavyAtomCount: 18
HydrogenBondAcceptorCount: 6
HydrogenBondDonorCount: 2
RotatableBondCount: 7
Xlogp3: 0.6
CatalogNumber:
AG32818
ChemicalName:
3-[(3-Methoxypropyl)sulfamoyl]benzoic acid
CasNumber:
500292-39-7
MolecularFormula:
C11H15NO5S
MolecularWeight:
273.3055
MdlNumber:
MFCD08337775
Smiles:
COCCCNS(=O)(=O)c1cccc(c1)C(=O)O
Complexity:
362
Covalently-bondedUnitCount:
1
HeavyAtomCount:
18
HydrogenBondAcceptorCount:
6
HydrogenBondDonorCount:
2
RotatableBondCount:
7
Xlogp3:
0.6