AB79333
219580-32-2 | tert-Butyl 1H-Pyrazole-1-carboxylate
Manufacturer: A2B Chem
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CatalogNumber
AB79333
ChemicalName
tert-Butyl 1H-Pyrazole-1-carboxylate
CasNumber
219580-32-2
MolecularFormula
C8H12N2O2
MolecularWeight
168.19308
MdlNumber
MFCD00800729
Smiles
O=C(n1cccn1)OC(C)(C)C
Complexity
174
Covalently-bondedUnitCount
1
HeavyAtomCount
12
HydrogenBondAcceptorCount
3
RotatableBondCount
2
Xlogp3
1.5
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CatalogNumber: AB79333
ChemicalName: tert-Butyl 1H-Pyrazole-1-carboxylate
CasNumber: 219580-32-2
MolecularFormula: C8H12N2O2
MolecularWeight: 168.19308
MdlNumber: MFCD00800729
Smiles: O=C(n1cccn1)OC(C)(C)C
Complexity: 174
Covalently-bondedUnitCount: 1
HeavyAtomCount: 12
HydrogenBondAcceptorCount: 3
RotatableBondCount: 2
Xlogp3: 1.5
CatalogNumber:
AB79333
ChemicalName:
tert-Butyl 1H-Pyrazole-1-carboxylate
CasNumber:
219580-32-2
MolecularFormula:
C8H12N2O2
MolecularWeight:
168.19308
MdlNumber:
MFCD00800729
Smiles:
O=C(n1cccn1)OC(C)(C)C
Complexity:
174
Covalently-bondedUnitCount:
1
HeavyAtomCount:
12
HydrogenBondAcceptorCount:
3
RotatableBondCount:
2
Xlogp3:
1.5
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: O=C(N1Cc2ccccc2C2(C1)CCNCC2)OC(C)(C)C
Complexity: 410
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
RotatableBondCount: __
Xlogp3: 2.5
CatalogNumber:
__
ChemicalName:
__
CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
__
Smiles:
O=C(N1Cc2ccccc2C2(C1)CCNCC2)OC(C)(C)C
Complexity:
410
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
RotatableBondCount:
__
Xlogp3:
2.5
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: CN(CC(=O)OC(C)(C)C)N
Complexity: __
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HeavyAtomCount: __
HydrogenBondAcceptorCount: __
RotatableBondCount: __
Xlogp3: __
CatalogNumber:
__
ChemicalName:
__
CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
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Smiles:
CN(CC(=O)OC(C)(C)C)N
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
RotatableBondCount:
__
Xlogp3:
__
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: O=C(n1c(cc2c1cccc2)B1OC(C(O1)(C)C)(C)C)OC(C)(C)C
Complexity: __
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
RotatableBondCount: __
Xlogp3: __
CatalogNumber:
__
ChemicalName:
__
CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
__
Smiles:
O=C(n1c(cc2c1cccc2)B1OC(C(O1)(C)C)(C)C)OC(C)(C)C
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
RotatableBondCount:
__
Xlogp3:
__