AE61935
1352318-13-8 | 3-(4-Nitrophenyl)pyridine-2-carbonitrile
Manufacturer: A2B Chem
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CatalogNumber
AE61935
ChemicalName
3-(4-Nitrophenyl)pyridine-2-carbonitrile
CasNumber
1352318-13-8
MolecularFormula
C12H7N3O2
MolecularWeight
225.2029
MdlNumber
MFCD20491460
Smiles
N#Cc1ncccc1c1ccc(cc1)[N+](=O)[O-]
Complexity
322
Covalently-bondedUnitCount
1
HeavyAtomCount
17
HydrogenBondAcceptorCount
4
RotatableBondCount
1
Xlogp3
2.4
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CatalogNumber: AE61935
ChemicalName: 3-(4-Nitrophenyl)pyridine-2-carbonitrile
CasNumber: 1352318-13-8
MolecularFormula: C12H7N3O2
MolecularWeight: 225.2029
MdlNumber: MFCD20491460
Smiles: N#Cc1ncccc1c1ccc(cc1)[N+](=O)[O-]
Complexity: 322
Covalently-bondedUnitCount: 1
HeavyAtomCount: 17
HydrogenBondAcceptorCount: 4
RotatableBondCount: 1
Xlogp3: 2.4
CatalogNumber:
AE61935
ChemicalName:
3-(4-Nitrophenyl)pyridine-2-carbonitrile
CasNumber:
1352318-13-8
MolecularFormula:
C12H7N3O2
MolecularWeight:
225.2029
MdlNumber:
MFCD20491460
Smiles:
N#Cc1ncccc1c1ccc(cc1)[N+](=O)[O-]
Complexity:
322
Covalently-bondedUnitCount:
1
HeavyAtomCount:
17
HydrogenBondAcceptorCount:
4
RotatableBondCount:
1
Xlogp3:
2.4
CatalogNumber: AE61936
ChemicalName: 4-Bromo-2-(diethylaminomethyl)-1-fluorobenzene
CasNumber: 1355248-25-7
MolecularFormula: C11H15BrFN
MolecularWeight: 260.1459
MdlNumber: MFCD21333055
Smiles: CCN(Cc1cc(Br)ccc1F)CC
Complexity: 161
Covalently-bondedUnitCount: 1
HeavyAtomCount: 14
HydrogenBondAcceptorCount: 2
RotatableBondCount: 4
Xlogp3: 3.3
CatalogNumber:
AE61936
ChemicalName:
4-Bromo-2-(diethylaminomethyl)-1-fluorobenzene
CasNumber:
1355248-25-7
MolecularFormula:
C11H15BrFN
MolecularWeight:
260.1459
MdlNumber:
MFCD21333055
Smiles:
CCN(Cc1cc(Br)ccc1F)CC
Complexity:
161
Covalently-bondedUnitCount:
1
HeavyAtomCount:
14
HydrogenBondAcceptorCount:
2
RotatableBondCount:
4
Xlogp3:
3.3
CatalogNumber: AE61937
ChemicalName: 3-(3-Chloro-4-methylphenyl)phenylacetic acid
CasNumber: 1352318-33-2
MolecularFormula: C15H13ClO2
MolecularWeight: 260.7155
MdlNumber: MFCD20529505
Smiles: OC(=O)Cc1cccc(c1)c1ccc(c(c1)Cl)C
Complexity: 292
Covalently-bondedUnitCount: 1
HeavyAtomCount: 18
HydrogenBondAcceptorCount: 2
RotatableBondCount: 3
Xlogp3: 4
CatalogNumber:
AE61937
ChemicalName:
3-(3-Chloro-4-methylphenyl)phenylacetic acid
CasNumber:
1352318-33-2
MolecularFormula:
C15H13ClO2
MolecularWeight:
260.7155
MdlNumber:
MFCD20529505
Smiles:
OC(=O)Cc1cccc(c1)c1ccc(c(c1)Cl)C
Complexity:
292
Covalently-bondedUnitCount:
1
HeavyAtomCount:
18
HydrogenBondAcceptorCount:
2
RotatableBondCount:
3
Xlogp3:
4
CatalogNumber: __
ChemicalName: __
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MolecularFormula: __
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Smiles: COC(=O)c1cc(Br)cc(c1F)N
Complexity: __
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HeavyAtomCount: __
HydrogenBondAcceptorCount: __
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Xlogp3: __
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MolecularFormula:
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Smiles:
COC(=O)c1cc(Br)cc(c1F)N
Complexity:
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Covalently-bondedUnitCount:
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HeavyAtomCount:
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HydrogenBondAcceptorCount:
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RotatableBondCount:
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Xlogp3:
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