AH15383
66207-08-7 | Benzyl 7-oxa-3-azabicyclo[4.1.0]heptane-3-carboxylate
Manufacturer: A2B Chem
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CatalogNumber
AH15383
ChemicalName
Benzyl 7-oxa-3-azabicyclo[4.1.0]heptane-3-carboxylate
CasNumber
66207-08-7
MolecularFormula
C13H15NO3
MolecularWeight
233.2631
MdlNumber
MFCD12407051
Smiles
O=C(N1CCC2C(C1)O2)OCc1ccccc1
Complexity
288
Covalently-bondedUnitCount
1
HeavyAtomCount
17
HydrogenBondAcceptorCount
3
RotatableBondCount
3
UndefinedAtomStereocenterCount
2
Xlogp3
1.5
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CatalogNumber: AH15383
ChemicalName: Benzyl 7-oxa-3-azabicyclo[4.1.0]heptane-3-carboxylate
CasNumber: 66207-08-7
MolecularFormula: C13H15NO3
MolecularWeight: 233.2631
MdlNumber: MFCD12407051
Smiles: O=C(N1CCC2C(C1)O2)OCc1ccccc1
Complexity: 288
Covalently-bondedUnitCount: 1
HeavyAtomCount: 17
HydrogenBondAcceptorCount: 3
RotatableBondCount: 3
UndefinedAtomStereocenterCount: 2
Xlogp3: 1.5
CatalogNumber:
AH15383
ChemicalName:
Benzyl 7-oxa-3-azabicyclo[4.1.0]heptane-3-carboxylate
CasNumber:
66207-08-7
MolecularFormula:
C13H15NO3
MolecularWeight:
233.2631
MdlNumber:
MFCD12407051
Smiles:
O=C(N1CCC2C(C1)O2)OCc1ccccc1
Complexity:
288
Covalently-bondedUnitCount:
1
HeavyAtomCount:
17
HydrogenBondAcceptorCount:
3
RotatableBondCount:
3
UndefinedAtomStereocenterCount:
2
Xlogp3:
1.5
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Smiles: Brc1ccccc1COc1ccccc1C(=O)O
Complexity: __
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Smiles:
Brc1ccccc1COc1ccccc1C(=O)O
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Smiles: Sc1nc2c(n1c1ccccc1)CCCC2
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Smiles:
Sc1nc2c(n1c1ccccc1)CCCC2
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HydrogenBondAcceptorCount:
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RotatableBondCount:
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UndefinedAtomStereocenterCount:
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Smiles: OC(=O)COc1c(I)cc(c2c1nccc2)Cl
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HeavyAtomCount: __
HydrogenBondAcceptorCount: __
RotatableBondCount: __
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__
ChemicalName:
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CasNumber:
__
MolecularFormula:
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MolecularWeight:
__
MdlNumber:
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Smiles:
OC(=O)COc1c(I)cc(c2c1nccc2)Cl
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
RotatableBondCount:
__
UndefinedAtomStereocenterCount:
__
Xlogp3:
__