AF59309
42206-47-3 | 2-Methyl-2-(4-nitrophenyl)-propionic acid
Manufacturer: A2B Chem
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CatalogNumber
AF59309
ChemicalName
2-Methyl-2-(4-nitrophenyl)-propionic acid
CasNumber
42206-47-3
MolecularFormula
C10H11NO4
MolecularWeight
209.19863999999998
MdlNumber
MFCD00816185
Smiles
OC(=O)C(c1ccc(cc1)[N+](=O)[O-])(C)C
Complexity
261
Covalently-bondedUnitCount
1
HeavyAtomCount
15
HydrogenBondAcceptorCount
4
HydrogenBondDonorCount
1
RotatableBondCount
2
Xlogp3
2.1
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CatalogNumber: AF59309
ChemicalName: 2-Methyl-2-(4-nitrophenyl)-propionic acid
CasNumber: 42206-47-3
MolecularFormula: C10H11NO4
MolecularWeight: 209.19863999999998
MdlNumber: MFCD00816185
Smiles: OC(=O)C(c1ccc(cc1)[N+](=O)[O-])(C)C
Complexity: 261
Covalently-bondedUnitCount: 1
HeavyAtomCount: 15
HydrogenBondAcceptorCount: 4
HydrogenBondDonorCount: 1
RotatableBondCount: 2
Xlogp3: 2.1
CatalogNumber:
AF59309
ChemicalName:
2-Methyl-2-(4-nitrophenyl)-propionic acid
CasNumber:
42206-47-3
MolecularFormula:
C10H11NO4
MolecularWeight:
209.19863999999998
MdlNumber:
MFCD00816185
Smiles:
OC(=O)C(c1ccc(cc1)[N+](=O)[O-])(C)C
Complexity:
261
Covalently-bondedUnitCount:
1
HeavyAtomCount:
15
HydrogenBondAcceptorCount:
4
HydrogenBondDonorCount:
1
RotatableBondCount:
2
Xlogp3:
2.1
CatalogNumber: __
ChemicalName: __
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MolecularFormula: __
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Smiles: OC(=O)CCCC1CCCN(C1)C(=O)OC(C)(C)C
Complexity: __
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
HydrogenBondDonorCount: __
RotatableBondCount: __
Xlogp3: __
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MolecularFormula:
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MolecularWeight:
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Smiles:
OC(=O)CCCC1CCCN(C1)C(=O)OC(C)(C)C
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
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HydrogenBondDonorCount:
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RotatableBondCount:
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ChemicalName: __
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MolecularFormula: __
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Smiles: O=C(NCc1cccc(c1)N)OCc1ccccc1
Complexity: __
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
HydrogenBondDonorCount: __
RotatableBondCount: __
Xlogp3: __
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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:
O=C(NCc1cccc(c1)N)OCc1ccccc1
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
HydrogenBondDonorCount:
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RotatableBondCount:
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Xlogp3:
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ChemicalName: __
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MolecularFormula: __
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Smiles: NCc1cccc(c1)C(=N)N.Cl.Cl
Complexity: __
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
HydrogenBondDonorCount: __
RotatableBondCount: __
Xlogp3: __
CatalogNumber:
__
ChemicalName:
__
CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
__
Smiles:
NCc1cccc(c1)C(=N)N.Cl.Cl
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
HydrogenBondDonorCount:
__
RotatableBondCount:
__
Xlogp3:
__