AA39431
1305322-90-0 | 4-Bromo-N-t-butyl-2-nitro-5-propoxyaniline
Manufacturer: A2B Chem
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CatalogNumber
AA39431
ChemicalName
4-Bromo-N-t-butyl-2-nitro-5-propoxyaniline
CasNumber
1305322-90-0
MolecularFormula
C13H19BrN2O3
MolecularWeight
331.2056
MdlNumber
MFCD18914493
Smiles
CCCOc1cc(NC(C)(C)C)c(cc1Br)[N+](=O)[O-]
Complexity
301
Covalently-bondedUnitCount
1
HeavyAtomCount
19
HydrogenBondAcceptorCount
4
HydrogenBondDonorCount
1
RotatableBondCount
5
Xlogp3
4.8
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CatalogNumber: AA39431
ChemicalName: 4-Bromo-N-t-butyl-2-nitro-5-propoxyaniline
CasNumber: 1305322-90-0
MolecularFormula: C13H19BrN2O3
MolecularWeight: 331.2056
MdlNumber: MFCD18914493
Smiles: CCCOc1cc(NC(C)(C)C)c(cc1Br)[N+](=O)[O-]
Complexity: 301
Covalently-bondedUnitCount: 1
HeavyAtomCount: 19
HydrogenBondAcceptorCount: 4
HydrogenBondDonorCount: 1
RotatableBondCount: 5
Xlogp3: 4.8
CatalogNumber:
AA39431
ChemicalName:
4-Bromo-N-t-butyl-2-nitro-5-propoxyaniline
CasNumber:
1305322-90-0
MolecularFormula:
C13H19BrN2O3
MolecularWeight:
331.2056
MdlNumber:
MFCD18914493
Smiles:
CCCOc1cc(NC(C)(C)C)c(cc1Br)[N+](=O)[O-]
Complexity:
301
Covalently-bondedUnitCount:
1
HeavyAtomCount:
19
HydrogenBondAcceptorCount:
4
HydrogenBondDonorCount:
1
RotatableBondCount:
5
Xlogp3:
4.8
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
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Smiles: O[C@H]1CCN(C1)C(=O)N(C)C
Complexity: __
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
HydrogenBondDonorCount: __
RotatableBondCount: __
Xlogp3: __
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Smiles:
O[C@H]1CCN(C1)C(=O)N(C)C
Complexity:
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Covalently-bondedUnitCount:
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HeavyAtomCount:
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HydrogenBondAcceptorCount:
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Smiles: OCC1CCN(CC1NC(c1ccccc1)C)C(=O)OC(C)(C)C
Complexity: __
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Smiles:
OCC1CCN(CC1NC(c1ccccc1)C)C(=O)OC(C)(C)C
Complexity:
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HeavyAtomCount:
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RotatableBondCount:
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Smiles: NCCNC(=O)Cn1nnc(n1)c1cccc(c1)Oc1ccccc1
Complexity: __
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MolecularFormula:
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MolecularWeight:
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Smiles:
NCCNC(=O)Cn1nnc(n1)c1cccc(c1)Oc1ccccc1
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
HydrogenBondDonorCount:
__
RotatableBondCount:
__
Xlogp3:
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