AI15034
1228453-28-8 | tert-Butyl 4-amino-5-methylazepane-1-carboxylate
Manufacturer: A2B Chem
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CatalogNumber
AI15034
ChemicalName
tert-Butyl 4-amino-5-methylazepane-1-carboxylate
CasNumber
1228453-28-8
MolecularFormula
C12H24N2O2
MolecularWeight
228.33115999999995
MdlNumber
MFCD27997439
Smiles
CC1CCN(CCC1N)C(=O)OC(C)(C)C
Complexity
248
Covalently-bondedUnitCount
1
HeavyAtomCount
16
HydrogenBondAcceptorCount
3
HydrogenBondDonorCount
1
RotatableBondCount
2
UndefinedAtomStereocenterCount
2
Xlogp3
1.5
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CatalogNumber: AI15034
ChemicalName: tert-Butyl 4-amino-5-methylazepane-1-carboxylate
CasNumber: 1228453-28-8
MolecularFormula: C12H24N2O2
MolecularWeight: 228.33115999999995
MdlNumber: MFCD27997439
Smiles: CC1CCN(CCC1N)C(=O)OC(C)(C)C
Complexity: 248
Covalently-bondedUnitCount: 1
HeavyAtomCount: 16
HydrogenBondAcceptorCount: 3
HydrogenBondDonorCount: 1
RotatableBondCount: 2
UndefinedAtomStereocenterCount: 2
Xlogp3: 1.5
CatalogNumber:
AI15034
ChemicalName:
tert-Butyl 4-amino-5-methylazepane-1-carboxylate
CasNumber:
1228453-28-8
MolecularFormula:
C12H24N2O2
MolecularWeight:
228.33115999999995
MdlNumber:
MFCD27997439
Smiles:
CC1CCN(CCC1N)C(=O)OC(C)(C)C
Complexity:
248
Covalently-bondedUnitCount:
1
HeavyAtomCount:
16
HydrogenBondAcceptorCount:
3
HydrogenBondDonorCount:
1
RotatableBondCount:
2
UndefinedAtomStereocenterCount:
2
Xlogp3:
1.5
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Smiles: B(C1=CC=CC=C1C2=CSC=C2)(O)O
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B(C1=CC=CC=C1C2=CSC=C2)(O)O
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RotatableBondCount:
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Smiles: __
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Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
HydrogenBondDonorCount: __
RotatableBondCount: __
UndefinedAtomStereocenterCount: __
Xlogp3: __
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CasNumber:
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MolecularFormula:
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MolecularWeight:
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MdlNumber:
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Smiles:
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Complexity:
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Covalently-bondedUnitCount:
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HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
HydrogenBondDonorCount:
__
RotatableBondCount:
__
UndefinedAtomStereocenterCount:
__
Xlogp3:
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