AA20417
1153949-11-1 | tert-Butyl 3-(cyanomethylene)azetidine-1-carboxylate
Manufacturer: A2B Chem
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CatalogNumber
AA20417
ChemicalName
tert-Butyl 3-(cyanomethylene)azetidine-1-carboxylate
CasNumber
1153949-11-1
MolecularFormula
C10H14N2O2
MolecularWeight
194.2304
MdlNumber
MFCD12761241
Smiles
N#CC=C1CN(C1)C(=O)OC(C)(C)C
Complexity
309
Covalently-bondedUnitCount
1
HeavyAtomCount
14
HydrogenBondAcceptorCount
3
RotatableBondCount
2
Xlogp3
0.3
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CatalogNumber: AA20417
ChemicalName: tert-Butyl 3-(cyanomethylene)azetidine-1-carboxylate
CasNumber: 1153949-11-1
MolecularFormula: C10H14N2O2
MolecularWeight: 194.2304
MdlNumber: MFCD12761241
Smiles: N#CC=C1CN(C1)C(=O)OC(C)(C)C
Complexity: 309
Covalently-bondedUnitCount: 1
HeavyAtomCount: 14
HydrogenBondAcceptorCount: 3
RotatableBondCount: 2
Xlogp3: 0.3
CatalogNumber:
AA20417
ChemicalName:
tert-Butyl 3-(cyanomethylene)azetidine-1-carboxylate
CasNumber:
1153949-11-1
MolecularFormula:
C10H14N2O2
MolecularWeight:
194.2304
MdlNumber:
MFCD12761241
Smiles:
N#CC=C1CN(C1)C(=O)OC(C)(C)C
Complexity:
309
Covalently-bondedUnitCount:
1
HeavyAtomCount:
14
HydrogenBondAcceptorCount:
3
RotatableBondCount:
2
Xlogp3:
0.3
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Smiles: O=C(N1CCN(CC1)CC(=O)O)OCc1ccccc1
Complexity: __
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Smiles:
O=C(N1CCN(CC1)CC(=O)O)OCc1ccccc1
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Smiles: OC(=O)c1ccc(n1C)c1ccc(cc1)C(F)(F)F
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Smiles:
OC(=O)c1ccc(n1C)c1ccc(cc1)C(F)(F)F
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__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
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RotatableBondCount:
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Smiles: O=C1Nc2c(C1)cc(c(c2)Cl)Br
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__
ChemicalName:
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CasNumber:
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MolecularFormula:
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MolecularWeight:
__
MdlNumber:
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Smiles:
O=C1Nc2c(C1)cc(c(c2)Cl)Br
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
RotatableBondCount:
__
Xlogp3:
__