AH11949
644982-12-7 | tert-Butyl 3-fluoro-4-oxoazepane-1-carboxylate
Manufacturer: A2B Chem
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CatalogNumber
AH11949
ChemicalName
tert-Butyl 3-fluoro-4-oxoazepane-1-carboxylate
CasNumber
644982-12-7
MolecularFormula
C11H18FNO3
MolecularWeight
231.2639
MdlNumber
MFCD11559002
Smiles
O=C1CCCN(CC1F)C(=O)OC(C)(C)C
Complexity
285
Covalently-bondedUnitCount
1
HeavyAtomCount
16
HydrogenBondAcceptorCount
4
RotatableBondCount
2
UndefinedAtomStereocenterCount
1
Xlogp3
1.4
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CatalogNumber: AH11949
ChemicalName: tert-Butyl 3-fluoro-4-oxoazepane-1-carboxylate
CasNumber: 644982-12-7
MolecularFormula: C11H18FNO3
MolecularWeight: 231.2639
MdlNumber: MFCD11559002
Smiles: O=C1CCCN(CC1F)C(=O)OC(C)(C)C
Complexity: 285
Covalently-bondedUnitCount: 1
HeavyAtomCount: 16
HydrogenBondAcceptorCount: 4
RotatableBondCount: 2
UndefinedAtomStereocenterCount: 1
Xlogp3: 1.4
CatalogNumber:
AH11949
ChemicalName:
tert-Butyl 3-fluoro-4-oxoazepane-1-carboxylate
CasNumber:
644982-12-7
MolecularFormula:
C11H18FNO3
MolecularWeight:
231.2639
MdlNumber:
MFCD11559002
Smiles:
O=C1CCCN(CC1F)C(=O)OC(C)(C)C
Complexity:
285
Covalently-bondedUnitCount:
1
HeavyAtomCount:
16
HydrogenBondAcceptorCount:
4
RotatableBondCount:
2
UndefinedAtomStereocenterCount:
1
Xlogp3:
1.4
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Smiles: Nc1nc(C)ccc1S(=O)(=O)N
Complexity: __
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HydrogenBondAcceptorCount: __
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Smiles:
Nc1nc(C)ccc1S(=O)(=O)N
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Smiles: CN1C[C@H](OC1=O)CO
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CasNumber:
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MolecularFormula:
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Smiles:
CN1C[C@H](OC1=O)CO
Complexity:
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Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
RotatableBondCount:
__
UndefinedAtomStereocenterCount:
__
Xlogp3:
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