AG19748
50877-41-3 | 1-Benzyl-4-bromo-1H-pyrazole
Manufacturer: A2B Chem
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CatalogNumber
AG19748
ChemicalName
1-Benzyl-4-bromo-1H-pyrazole
CasNumber
50877-41-3
MolecularFormula
C10H9BrN2
MolecularWeight
237.0959
MdlNumber
MFCD02179566
Smiles
Brc1cnn(c1)Cc1ccccc1
Complexity
157
Covalently-bondedUnitCount
1
HeavyAtomCount
13
HydrogenBondAcceptorCount
1
RotatableBondCount
2
Xlogp3
2.5
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CatalogNumber: AG19748
ChemicalName: 1-Benzyl-4-bromo-1H-pyrazole
CasNumber: 50877-41-3
MolecularFormula: C10H9BrN2
MolecularWeight: 237.0959
MdlNumber: MFCD02179566
Smiles: Brc1cnn(c1)Cc1ccccc1
Complexity: 157
Covalently-bondedUnitCount: 1
HeavyAtomCount: 13
HydrogenBondAcceptorCount: 1
RotatableBondCount: 2
Xlogp3: 2.5
CatalogNumber:
AG19748
ChemicalName:
1-Benzyl-4-bromo-1H-pyrazole
CasNumber:
50877-41-3
MolecularFormula:
C10H9BrN2
MolecularWeight:
237.0959
MdlNumber:
MFCD02179566
Smiles:
Brc1cnn(c1)Cc1ccccc1
Complexity:
157
Covalently-bondedUnitCount:
1
HeavyAtomCount:
13
HydrogenBondAcceptorCount:
1
RotatableBondCount:
2
Xlogp3:
2.5
CatalogNumber: AG19749
ChemicalName: Ethyl indole-4-carboxylate
CasNumber: 50614-84-1
MolecularFormula: C11H11NO2
MolecularWeight: 189.2105
MdlNumber: MFCD00009738
Smiles: CCOC(=O)c1cccc2c1cc[nH]2
Complexity: 217
Covalently-bondedUnitCount: 1
HeavyAtomCount: 14
HydrogenBondAcceptorCount: 2
RotatableBondCount: 3
Xlogp3: 2
CatalogNumber:
AG19749
ChemicalName:
Ethyl indole-4-carboxylate
CasNumber:
50614-84-1
MolecularFormula:
C11H11NO2
MolecularWeight:
189.2105
MdlNumber:
MFCD00009738
Smiles:
CCOC(=O)c1cccc2c1cc[nH]2
Complexity:
217
Covalently-bondedUnitCount:
1
HeavyAtomCount:
14
HydrogenBondAcceptorCount:
2
RotatableBondCount:
3
Xlogp3:
2
CatalogNumber: AG19750
ChemicalName: tert-Butyl 5-bromo-2-chlorobenzoate
CasNumber: 503555-23-5
MolecularFormula: C11H12BrClO2
MolecularWeight: 291.5688
MdlNumber: MFCD09800903
Smiles: O=C(c1cc(Br)ccc1Cl)OC(C)(C)C
Complexity: 237
Covalently-bondedUnitCount: 1
HeavyAtomCount: 15
HydrogenBondAcceptorCount: 2
RotatableBondCount: 3
Xlogp3: 4.2
CatalogNumber:
AG19750
ChemicalName:
tert-Butyl 5-bromo-2-chlorobenzoate
CasNumber:
503555-23-5
MolecularFormula:
C11H12BrClO2
MolecularWeight:
291.5688
MdlNumber:
MFCD09800903
Smiles:
O=C(c1cc(Br)ccc1Cl)OC(C)(C)C
Complexity:
237
Covalently-bondedUnitCount:
1
HeavyAtomCount:
15
HydrogenBondAcceptorCount:
2
RotatableBondCount:
3
Xlogp3:
4.2
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: COc1ccc(cc1)COc1cncc(c1)Br
Complexity: 220
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
RotatableBondCount: __
Xlogp3: 3
CatalogNumber:
__
ChemicalName:
__
CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
__
Smiles:
COc1ccc(cc1)COc1cncc(c1)Br
Complexity:
220
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
RotatableBondCount:
__
Xlogp3:
3