AE62125
133851-67-9 | 1-[(4-Nitrophenyl)methyl]pyrrolidine
Manufacturer: A2B Chem
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CatalogNumber
AE62125
ChemicalName
1-[(4-Nitrophenyl)methyl]pyrrolidine
CasNumber
133851-67-9
MolecularFormula
C11H14N2O2
MolecularWeight
206.2411
MdlNumber
MFCD02051488
Smiles
[O-][N+](=O)c1ccc(cc1)CN1CCCC1
Complexity
213
Covalently-bondedUnitCount
1
HeavyAtomCount
15
HydrogenBondAcceptorCount
3
RotatableBondCount
2
Xlogp3
2.1
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CatalogNumber: AE62125
ChemicalName: 1-[(4-Nitrophenyl)methyl]pyrrolidine
CasNumber: 133851-67-9
MolecularFormula: C11H14N2O2
MolecularWeight: 206.2411
MdlNumber: MFCD02051488
Smiles: [O-][N+](=O)c1ccc(cc1)CN1CCCC1
Complexity: 213
Covalently-bondedUnitCount: 1
HeavyAtomCount: 15
HydrogenBondAcceptorCount: 3
RotatableBondCount: 2
Xlogp3: 2.1
CatalogNumber:
AE62125
ChemicalName:
1-[(4-Nitrophenyl)methyl]pyrrolidine
CasNumber:
133851-67-9
MolecularFormula:
C11H14N2O2
MolecularWeight:
206.2411
MdlNumber:
MFCD02051488
Smiles:
[O-][N+](=O)c1ccc(cc1)CN1CCCC1
Complexity:
213
Covalently-bondedUnitCount:
1
HeavyAtomCount:
15
HydrogenBondAcceptorCount:
3
RotatableBondCount:
2
Xlogp3:
2.1
CatalogNumber: AE62126
ChemicalName: 4-Nitro-3-(propylamino)benzoic acid
CasNumber: 1400644-69-0
MolecularFormula: C10H12N2O4
MolecularWeight: 224.2133
MdlNumber: MFCD22421482
Smiles: [O-][N+](=O)c1ccc(cc1NCCC)C(=O)O
Complexity: 264
Covalently-bondedUnitCount: 1
HeavyAtomCount: 16
HydrogenBondAcceptorCount: 5
RotatableBondCount: 4
Xlogp3: 3.2
CatalogNumber:
AE62126
ChemicalName:
4-Nitro-3-(propylamino)benzoic acid
CasNumber:
1400644-69-0
MolecularFormula:
C10H12N2O4
MolecularWeight:
224.2133
MdlNumber:
MFCD22421482
Smiles:
[O-][N+](=O)c1ccc(cc1NCCC)C(=O)O
Complexity:
264
Covalently-bondedUnitCount:
1
HeavyAtomCount:
16
HydrogenBondAcceptorCount:
5
RotatableBondCount:
4
Xlogp3:
3.2
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Smiles: CN1CCN(CC1)c1c(F)cc2c3c1OCC(n3cc(c2=O)C(=O)O)C.Cl
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Smiles:
CN1CCN(CC1)c1c(F)cc2c3c1OCC(n3cc(c2=O)C(=O)O)C.Cl
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Smiles: COc1ccc(cc1)c1ccc(cn1)O
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Smiles:
COc1ccc(cc1)c1ccc(cn1)O
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HydrogenBondAcceptorCount:
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