AI50441
438533-54-1 | N,N'-Bis(tert-butoxycarbonyl)-o-phenylenediamine
Manufacturer: A2B Chem
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CatalogNumber
AI50441
ChemicalName
N,N'-Bis(tert-butoxycarbonyl)-o-phenylenediamine
CasNumber
438533-54-1
MolecularFormula
C16H24N2O4
MolecularWeight
308.3728
MdlNumber
MFCD24465598
Smiles
O=C(Nc1ccccc1NC(=O)OC(C)(C)C)OC(C)(C)C
Complexity
358
Covalently-bondedUnitCount
1
HeavyAtomCount
22
HydrogenBondAcceptorCount
4
HydrogenBondDonorCount
2
RotatableBondCount
6
Xlogp3
3.1
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CatalogNumber: AI50441
ChemicalName: N,N'-Bis(tert-butoxycarbonyl)-o-phenylenediamine
CasNumber: 438533-54-1
MolecularFormula: C16H24N2O4
MolecularWeight: 308.3728
MdlNumber: MFCD24465598
Smiles: O=C(Nc1ccccc1NC(=O)OC(C)(C)C)OC(C)(C)C
Complexity: 358
Covalently-bondedUnitCount: 1
HeavyAtomCount: 22
HydrogenBondAcceptorCount: 4
HydrogenBondDonorCount: 2
RotatableBondCount: 6
Xlogp3: 3.1
CatalogNumber:
AI50441
ChemicalName:
N,N'-Bis(tert-butoxycarbonyl)-o-phenylenediamine
CasNumber:
438533-54-1
MolecularFormula:
C16H24N2O4
MolecularWeight:
308.3728
MdlNumber:
MFCD24465598
Smiles:
O=C(Nc1ccccc1NC(=O)OC(C)(C)C)OC(C)(C)C
Complexity:
358
Covalently-bondedUnitCount:
1
HeavyAtomCount:
22
HydrogenBondAcceptorCount:
4
HydrogenBondDonorCount:
2
RotatableBondCount:
6
Xlogp3:
3.1
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Smiles: COC(=O)c1ccc2c(c1)nc1n(c2=O)CCS1
Complexity: __
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HeavyAtomCount: __
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Smiles:
COC(=O)c1ccc2c(c1)nc1n(c2=O)CCS1
Complexity:
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HeavyAtomCount:
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Smiles: COc1ccc(cc1)C(=O)NC(C(=O)O)CC(C)C
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Smiles:
COc1ccc(cc1)C(=O)NC(C(=O)O)CC(C)C
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HeavyAtomCount:
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HydrogenBondAcceptorCount:
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RotatableBondCount:
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Smiles: Nc1ccc(nc1)c1cc(F)cc(c1)F
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MolecularFormula:
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Smiles:
Nc1ccc(nc1)c1cc(F)cc(c1)F
Complexity:
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Covalently-bondedUnitCount:
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HeavyAtomCount:
__
HydrogenBondAcceptorCount:
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HydrogenBondDonorCount:
__
RotatableBondCount:
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Xlogp3:
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