AE13023
113261-00-0 | (3-Amino-phenyl)-carbamic acid benzyl ester
Manufacturer: A2B Chem
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CatalogNumber
AE13023
ChemicalName
(3-Amino-phenyl)-carbamic acid benzyl ester
CasNumber
113261-00-0
MolecularFormula
C14H14N2O2
MolecularWeight
242.2732
MdlNumber
MFCD06657917
Smiles
O=C(Nc1cccc(c1)N)OCc1ccccc1
Complexity
265
Covalently-bondedUnitCount
1
HeavyAtomCount
18
HydrogenBondAcceptorCount
3
HydrogenBondDonorCount
2
RotatableBondCount
4
Xlogp3
1.9
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CatalogNumber: AE13023
ChemicalName: (3-Amino-phenyl)-carbamic acid benzyl ester
CasNumber: 113261-00-0
MolecularFormula: C14H14N2O2
MolecularWeight: 242.2732
MdlNumber: MFCD06657917
Smiles: O=C(Nc1cccc(c1)N)OCc1ccccc1
Complexity: 265
Covalently-bondedUnitCount: 1
HeavyAtomCount: 18
HydrogenBondAcceptorCount: 3
HydrogenBondDonorCount: 2
RotatableBondCount: 4
Xlogp3: 1.9
CatalogNumber:
AE13023
ChemicalName:
(3-Amino-phenyl)-carbamic acid benzyl ester
CasNumber:
113261-00-0
MolecularFormula:
C14H14N2O2
MolecularWeight:
242.2732
MdlNumber:
MFCD06657917
Smiles:
O=C(Nc1cccc(c1)N)OCc1ccccc1
Complexity:
265
Covalently-bondedUnitCount:
1
HeavyAtomCount:
18
HydrogenBondAcceptorCount:
3
HydrogenBondDonorCount:
2
RotatableBondCount:
4
Xlogp3:
1.9
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MolecularFormula: __
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Smiles: OB1OB(O1)OB1OB(O1)O.O.O.O.O.N.N
Complexity: __
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
HydrogenBondDonorCount: __
RotatableBondCount: __
Xlogp3: __
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Smiles:
OB1OB(O1)OB1OB(O1)O.O.O.O.O.N.N
Complexity:
__
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HeavyAtomCount:
__
HydrogenBondAcceptorCount:
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RotatableBondCount:
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Smiles: c1ccc(cc1)c1ccc(nc1)c1nncc(n1)c1ccccc1
Complexity: __
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Smiles:
c1ccc(cc1)c1ccc(nc1)c1nncc(n1)c1ccccc1
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HeavyAtomCount:
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HydrogenBondAcceptorCount:
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RotatableBondCount:
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Smiles: F[Ta-2](F)(F)(F)(F)(F)F.[NH4+].[NH4+]
Complexity: __
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HeavyAtomCount: __
HydrogenBondAcceptorCount: __
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RotatableBondCount: __
Xlogp3: __
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__
ChemicalName:
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CasNumber:
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MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
__
Smiles:
F[Ta-2](F)(F)(F)(F)(F)F.[NH4+].[NH4+]
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
HydrogenBondDonorCount:
__
RotatableBondCount:
__
Xlogp3:
__