AI38426
1642899-83-9 | tert-Butyl 2-oxo-1-oxa-3,7-diazaspiro[4.4]nonane-7-carboxylate
Manufacturer: A2B Chem
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CatalogNumber
AI38426
ChemicalName
tert-Butyl 2-oxo-1-oxa-3,7-diazaspiro[4.4]nonane-7-carboxylate
CasNumber
1642899-83-9
MolecularFormula
C11H18N2O4
MolecularWeight
242.27161999999998
MdlNumber
MFCD27997309
Smiles
O=C1NCC2(O1)CCN(C2)C(=O)OC(C)(C)C
Complexity
350
Covalently-bondedUnitCount
1
HeavyAtomCount
17
HydrogenBondAcceptorCount
4
HydrogenBondDonorCount
1
RotatableBondCount
2
UndefinedAtomStereocenterCount
1
Xlogp3
0.6
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CatalogNumber: AI38426
ChemicalName: tert-Butyl 2-oxo-1-oxa-3,7-diazaspiro[4.4]nonane-7-carboxylate
CasNumber: 1642899-83-9
MolecularFormula: C11H18N2O4
MolecularWeight: 242.27161999999998
MdlNumber: MFCD27997309
Smiles: O=C1NCC2(O1)CCN(C2)C(=O)OC(C)(C)C
Complexity: 350
Covalently-bondedUnitCount: 1
HeavyAtomCount: 17
HydrogenBondAcceptorCount: 4
HydrogenBondDonorCount: 1
RotatableBondCount: 2
UndefinedAtomStereocenterCount: 1
Xlogp3: 0.6
CatalogNumber:
AI38426
ChemicalName:
tert-Butyl 2-oxo-1-oxa-3,7-diazaspiro[4.4]nonane-7-carboxylate
CasNumber:
1642899-83-9
MolecularFormula:
C11H18N2O4
MolecularWeight:
242.27161999999998
MdlNumber:
MFCD27997309
Smiles:
O=C1NCC2(O1)CCN(C2)C(=O)OC(C)(C)C
Complexity:
350
Covalently-bondedUnitCount:
1
HeavyAtomCount:
17
HydrogenBondAcceptorCount:
4
HydrogenBondDonorCount:
1
RotatableBondCount:
2
UndefinedAtomStereocenterCount:
1
Xlogp3:
0.6
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Smiles: C1=CC=C(C=C1)C2=NN=C3N2C=C(C=C3)I
Complexity: __
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Smiles:
C1=CC=C(C=C1)C2=NN=C3N2C=C(C=C3)I
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
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RotatableBondCount:
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UndefinedAtomStereocenterCount:
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Smiles: Oc1cnc(cc1N)C(F)(F)F
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__
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MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
__
Smiles:
Oc1cnc(cc1N)C(F)(F)F
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
HydrogenBondDonorCount:
__
RotatableBondCount:
__
UndefinedAtomStereocenterCount:
__
Xlogp3:
__
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MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: O=C(C(Br)(F)F)CC(=O)C
Complexity: __
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
HydrogenBondDonorCount: __
RotatableBondCount: __
UndefinedAtomStereocenterCount: __
Xlogp3: __
CatalogNumber:
__
ChemicalName:
__
CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
__
Smiles:
O=C(C(Br)(F)F)CC(=O)C
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
HydrogenBondDonorCount:
__
RotatableBondCount:
__
UndefinedAtomStereocenterCount:
__
Xlogp3:
__