AD63591
1126650-67-6 | 1-(tert-Butoxycarbonyl)-3-fluoroazetidine-3-carboxylic acid
Manufacturer: A2B Chem
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CatalogNumber
AD63591
ChemicalName
1-(tert-Butoxycarbonyl)-3-fluoroazetidine-3-carboxylic acid
CasNumber
1126650-67-6
MolecularFormula
C9H14FNO4
MolecularWeight
219.2102
MdlNumber
MFCD15071784
Smiles
O=C(N1CC(C1)(F)C(=O)O)OC(C)(C)C
Complexity
291
Covalently-bondedUnitCount
1
HeavyAtomCount
15
HydrogenBondAcceptorCount
5
HydrogenBondDonorCount
1
RotatableBondCount
3
Xlogp3
0.7
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CatalogNumber: AD63591
ChemicalName: 1-(tert-Butoxycarbonyl)-3-fluoroazetidine-3-carboxylic acid
CasNumber: 1126650-67-6
MolecularFormula: C9H14FNO4
MolecularWeight: 219.2102
MdlNumber: MFCD15071784
Smiles: O=C(N1CC(C1)(F)C(=O)O)OC(C)(C)C
Complexity: 291
Covalently-bondedUnitCount: 1
HeavyAtomCount: 15
HydrogenBondAcceptorCount: 5
HydrogenBondDonorCount: 1
RotatableBondCount: 3
Xlogp3: 0.7
CatalogNumber:
AD63591
ChemicalName:
1-(tert-Butoxycarbonyl)-3-fluoroazetidine-3-carboxylic acid
CasNumber:
1126650-67-6
MolecularFormula:
C9H14FNO4
MolecularWeight:
219.2102
MdlNumber:
MFCD15071784
Smiles:
O=C(N1CC(C1)(F)C(=O)O)OC(C)(C)C
Complexity:
291
Covalently-bondedUnitCount:
1
HeavyAtomCount:
15
HydrogenBondAcceptorCount:
5
HydrogenBondDonorCount:
1
RotatableBondCount:
3
Xlogp3:
0.7
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Smiles: N#CCc1ccc(c(c1)O)O
Complexity: __
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Smiles:
N#CCc1ccc(c(c1)O)O
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RotatableBondCount:
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Smiles: C=CCS(=O)c1cc2c(o1)cccc2
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Smiles:
C=CCS(=O)c1cc2c(o1)cccc2
Complexity:
__
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HeavyAtomCount:
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HydrogenBondAcceptorCount:
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RotatableBondCount:
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Smiles: Cc1onc(c1)N=Cc1ccccc1O
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MolecularFormula:
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MolecularWeight:
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Smiles:
Cc1onc(c1)N=Cc1ccccc1O
Complexity:
__
Covalently-bondedUnitCount:
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HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
HydrogenBondDonorCount:
__
RotatableBondCount:
__
Xlogp3:
__