AH55395
748805-97-2 | tert-Butyl 6-oxo-1,4-oxazepane-4-carboxylate
Manufacturer: A2B Chem
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CatalogNumber
AH55395
ChemicalName
tert-Butyl 6-oxo-1,4-oxazepane-4-carboxylate
CasNumber
748805-97-2
MolecularFormula
C10H17NO4
MolecularWeight
215.24627999999996
MdlNumber
MFCD11976154
Smiles
O=C1COCCN(C1)C(=O)OC(C)(C)C
Complexity
257
Covalently-bondedUnitCount
1
HeavyAtomCount
15
HydrogenBondAcceptorCount
4
RotatableBondCount
2
Xlogp3
0.6
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CatalogNumber: AH55395
ChemicalName: tert-Butyl 6-oxo-1,4-oxazepane-4-carboxylate
CasNumber: 748805-97-2
MolecularFormula: C10H17NO4
MolecularWeight: 215.24627999999996
MdlNumber: MFCD11976154
Smiles: O=C1COCCN(C1)C(=O)OC(C)(C)C
Complexity: 257
Covalently-bondedUnitCount: 1
HeavyAtomCount: 15
HydrogenBondAcceptorCount: 4
RotatableBondCount: 2
Xlogp3: 0.6
CatalogNumber:
AH55395
ChemicalName:
tert-Butyl 6-oxo-1,4-oxazepane-4-carboxylate
CasNumber:
748805-97-2
MolecularFormula:
C10H17NO4
MolecularWeight:
215.24627999999996
MdlNumber:
MFCD11976154
Smiles:
O=C1COCCN(C1)C(=O)OC(C)(C)C
Complexity:
257
Covalently-bondedUnitCount:
1
HeavyAtomCount:
15
HydrogenBondAcceptorCount:
4
RotatableBondCount:
2
Xlogp3:
0.6
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Smiles: O=c1[nH]c2c(n1C1CCNCC1)cccn2.Cl.Cl
Complexity: __
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
RotatableBondCount: __
Xlogp3: __
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Smiles:
O=c1[nH]c2c(n1C1CCNCC1)cccn2.Cl.Cl
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
RotatableBondCount:
__
Xlogp3:
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Smiles: OC(=O)C1CC1c1ccc(cc1)Br
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HeavyAtomCount: __
HydrogenBondAcceptorCount: __
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MolecularFormula:
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Smiles:
OC(=O)C1CC1c1ccc(cc1)Br
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
RotatableBondCount:
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Xlogp3:
__
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Smiles: NCCc1cncnc1
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HydrogenBondAcceptorCount: __
RotatableBondCount: __
Xlogp3: __
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__
ChemicalName:
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CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
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Smiles:
NCCc1cncnc1
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
RotatableBondCount:
__
Xlogp3:
__