AE67129
1314987-79-5 | tert-Butyl 3-(4-nitro-1H-pyrazol-1-yl)azetidine-1-carboxylate
Manufacturer: A2B Chem
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CatalogNumber
AE67129
ChemicalName
tert-Butyl 3-(4-nitro-1H-pyrazol-1-yl)azetidine-1-carboxylate
CasNumber
1314987-79-5
MolecularFormula
C11H16N4O4
MolecularWeight
268.26913999999994
MdlNumber
MFCD14155811
Smiles
O=C(N1CC(C1)n1ncc(c1)N(=O)=O)OC(C)(C)C
Complexity
370
Covalently-bondedUnitCount
1
HeavyAtomCount
19
HydrogenBondAcceptorCount
5
RotatableBondCount
3
Xlogp3
0.7
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CatalogNumber: AE67129
ChemicalName: tert-Butyl 3-(4-nitro-1H-pyrazol-1-yl)azetidine-1-carboxylate
CasNumber: 1314987-79-5
MolecularFormula: C11H16N4O4
MolecularWeight: 268.26913999999994
MdlNumber: MFCD14155811
Smiles: O=C(N1CC(C1)n1ncc(c1)N(=O)=O)OC(C)(C)C
Complexity: 370
Covalently-bondedUnitCount: 1
HeavyAtomCount: 19
HydrogenBondAcceptorCount: 5
RotatableBondCount: 3
Xlogp3: 0.7
CatalogNumber:
AE67129
ChemicalName:
tert-Butyl 3-(4-nitro-1H-pyrazol-1-yl)azetidine-1-carboxylate
CasNumber:
1314987-79-5
MolecularFormula:
C11H16N4O4
MolecularWeight:
268.26913999999994
MdlNumber:
MFCD14155811
Smiles:
O=C(N1CC(C1)n1ncc(c1)N(=O)=O)OC(C)(C)C
Complexity:
370
Covalently-bondedUnitCount:
1
HeavyAtomCount:
19
HydrogenBondAcceptorCount:
5
RotatableBondCount:
3
Xlogp3:
0.7
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Smiles: C1=CC(=C(C(=C1C(F)(F)F)Cl)O)F
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C1=CC(=C(C(=C1C(F)(F)F)Cl)O)F
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Smiles: BrC(=Cc1c(Cl)cncc1Cl)Br
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BrC(=Cc1c(Cl)cncc1Cl)Br
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Smiles: Clc1ccc(nc1)Oc1ccc(cc1)B1OC(C(O1)(C)C)(C)C
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Smiles:
Clc1ccc(nc1)Oc1ccc(cc1)B1OC(C(O1)(C)C)(C)C
Complexity:
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Covalently-bondedUnitCount:
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HeavyAtomCount:
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HydrogenBondAcceptorCount:
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RotatableBondCount:
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Xlogp3:
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