AE25201
1092791-47-3 | Methyl 4,5-dibromo-1H-pyrazole-3-carboxylate
Manufacturer: A2B Chem
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CatalogNumber
AE25201
ChemicalName
Methyl 4,5-dibromo-1H-pyrazole-3-carboxylate
CasNumber
1092791-47-3
MolecularFormula
C5H4Br2N2O2
MolecularWeight
283.9055
MdlNumber
MFCD23135916
Smiles
COC(=O)c1c(Br)c(n[nH]1)Br
Complexity
167
Covalently-bondedUnitCount
1
HeavyAtomCount
11
HydrogenBondAcceptorCount
3
HydrogenBondDonorCount
1
RotatableBondCount
2
Xlogp3
2.1
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CatalogNumber: AE25201
ChemicalName: Methyl 4,5-dibromo-1H-pyrazole-3-carboxylate
CasNumber: 1092791-47-3
MolecularFormula: C5H4Br2N2O2
MolecularWeight: 283.9055
MdlNumber: MFCD23135916
Smiles: COC(=O)c1c(Br)c(n[nH]1)Br
Complexity: 167
Covalently-bondedUnitCount: 1
HeavyAtomCount: 11
HydrogenBondAcceptorCount: 3
HydrogenBondDonorCount: 1
RotatableBondCount: 2
Xlogp3: 2.1
CatalogNumber:
AE25201
ChemicalName:
Methyl 4,5-dibromo-1H-pyrazole-3-carboxylate
CasNumber:
1092791-47-3
MolecularFormula:
C5H4Br2N2O2
MolecularWeight:
283.9055
MdlNumber:
MFCD23135916
Smiles:
COC(=O)c1c(Br)c(n[nH]1)Br
Complexity:
167
Covalently-bondedUnitCount:
1
HeavyAtomCount:
11
HydrogenBondAcceptorCount:
3
HydrogenBondDonorCount:
1
RotatableBondCount:
2
Xlogp3:
2.1
CatalogNumber: AE25202
ChemicalName: 4-Chloro-2-formylphenylboronic acid, pinacol ester
CasNumber: 1132669-91-0
MolecularFormula: C13H16BClO3
MolecularWeight: 266.5283399999999
MdlNumber: MFCD18731001
Smiles: O=Cc1cc(Cl)ccc1B1OC(C(O1)(C)C)(C)C
Complexity: 316
Covalently-bondedUnitCount: 1
HeavyAtomCount: 18
HydrogenBondAcceptorCount: 3
HydrogenBondDonorCount: __
RotatableBondCount: 2
Xlogp3: __
CatalogNumber:
AE25202
ChemicalName:
4-Chloro-2-formylphenylboronic acid, pinacol ester
CasNumber:
1132669-91-0
MolecularFormula:
C13H16BClO3
MolecularWeight:
266.5283399999999
MdlNumber:
MFCD18731001
Smiles:
O=Cc1cc(Cl)ccc1B1OC(C(O1)(C)C)(C)C
Complexity:
316
Covalently-bondedUnitCount:
1
HeavyAtomCount:
18
HydrogenBondAcceptorCount:
3
HydrogenBondDonorCount:
__
RotatableBondCount:
2
Xlogp3:
__
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: CCOC(COc1cccc(c1)OC)OCC
Complexity: __
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
HydrogenBondDonorCount: __
RotatableBondCount: __
Xlogp3: __
CatalogNumber:
__
ChemicalName:
__
CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
__
Smiles:
CCOC(COc1cccc(c1)OC)OCC
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
HydrogenBondDonorCount:
__
RotatableBondCount:
__
Xlogp3:
__
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: OC(=O)c1ccc2c(c1)nc[nH]2.Cl
Complexity: 196
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
HydrogenBondDonorCount: __
RotatableBondCount: __
Xlogp3: __
CatalogNumber:
__
ChemicalName:
__
CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
__
Smiles:
OC(=O)c1ccc2c(c1)nc[nH]2.Cl
Complexity:
196
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
HydrogenBondDonorCount:
__
RotatableBondCount:
__
Xlogp3:
__