AE03404
801315-75-3 | tert-Butyl 4-nitro-1h-indazole-1-carboxylate
Manufacturer: A2B Chem
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CatalogNumber
AE03404
ChemicalName
tert-Butyl 4-nitro-1h-indazole-1-carboxylate
CasNumber
801315-75-3
MolecularFormula
C12H13N3O4
MolecularWeight
263.2493
MdlNumber
MFCD11976290
Smiles
[O-][N+](=O)c1cccc2c1cnn2C(=O)OC(C)(C)C
Complexity
374
Covalently-bondedUnitCount
1
HeavyAtomCount
19
HydrogenBondAcceptorCount
5
RotatableBondCount
2
Xlogp3
2.7
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CatalogNumber: AE03404
ChemicalName: tert-Butyl 4-nitro-1h-indazole-1-carboxylate
CasNumber: 801315-75-3
MolecularFormula: C12H13N3O4
MolecularWeight: 263.2493
MdlNumber: MFCD11976290
Smiles: [O-][N+](=O)c1cccc2c1cnn2C(=O)OC(C)(C)C
Complexity: 374
Covalently-bondedUnitCount: 1
HeavyAtomCount: 19
HydrogenBondAcceptorCount: 5
RotatableBondCount: 2
Xlogp3: 2.7
CatalogNumber:
AE03404
ChemicalName:
tert-Butyl 4-nitro-1h-indazole-1-carboxylate
CasNumber:
801315-75-3
MolecularFormula:
C12H13N3O4
MolecularWeight:
263.2493
MdlNumber:
MFCD11976290
Smiles:
[O-][N+](=O)c1cccc2c1cnn2C(=O)OC(C)(C)C
Complexity:
374
Covalently-bondedUnitCount:
1
HeavyAtomCount:
19
HydrogenBondAcceptorCount:
5
RotatableBondCount:
2
Xlogp3:
2.7
CatalogNumber: AE03405
ChemicalName: tert-Butyl 4-amino-1H-indazole-1-carboxylate
CasNumber: 801315-74-2
MolecularFormula: C12H15N3O2
MolecularWeight: 233.2664
MdlNumber: MFCD11052618
Smiles: Nc1cccc2c1cnn2C(=O)OC(C)(C)C
Complexity: 301
Covalently-bondedUnitCount: 1
HeavyAtomCount: 17
HydrogenBondAcceptorCount: 4
RotatableBondCount: 2
Xlogp3: 2.2
CatalogNumber:
AE03405
ChemicalName:
tert-Butyl 4-amino-1H-indazole-1-carboxylate
CasNumber:
801315-74-2
MolecularFormula:
C12H15N3O2
MolecularWeight:
233.2664
MdlNumber:
MFCD11052618
Smiles:
Nc1cccc2c1cnn2C(=O)OC(C)(C)C
Complexity:
301
Covalently-bondedUnitCount:
1
HeavyAtomCount:
17
HydrogenBondAcceptorCount:
4
RotatableBondCount:
2
Xlogp3:
2.2
CatalogNumber: AE03406
ChemicalName: 1-(3-(Trifluoromethyl)pyridin-2-yl)piperidin-4-one
CasNumber: 801306-55-8
MolecularFormula: C11H11F3N2O
MolecularWeight: 244.213
MdlNumber: MFCD09927614
Smiles: O=C1CCN(CC1)c1ncccc1C(F)(F)F
Complexity: 283
Covalently-bondedUnitCount: 1
HeavyAtomCount: 17
HydrogenBondAcceptorCount: 6
RotatableBondCount: 1
Xlogp3: 1.6
CatalogNumber:
AE03406
ChemicalName:
1-(3-(Trifluoromethyl)pyridin-2-yl)piperidin-4-one
CasNumber:
801306-55-8
MolecularFormula:
C11H11F3N2O
MolecularWeight:
244.213
MdlNumber:
MFCD09927614
Smiles:
O=C1CCN(CC1)c1ncccc1C(F)(F)F
Complexity:
283
Covalently-bondedUnitCount:
1
HeavyAtomCount:
17
HydrogenBondAcceptorCount:
6
RotatableBondCount:
1
Xlogp3:
1.6
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Smiles: COc1cccc(c1F)NC(=O)OC(C)(C)C
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Smiles:
COc1cccc(c1F)NC(=O)OC(C)(C)C
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