AB50646
85230-37-1 | Ethyl 5-hydroxy-1H-pyrazole-3-carboxylate
Manufacturer: A2B Chem
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CatalogNumber
AB50646
ChemicalName
Ethyl 5-hydroxy-1H-pyrazole-3-carboxylate
CasNumber
85230-37-1
MolecularFormula
C6H8N2O3
MolecularWeight
156.1393
MdlNumber
MFCD09263987
Smiles
CCOC(=O)c1cc([nH]n1)O
Complexity
222
Covalently-bondedUnitCount
1
HeavyAtomCount
11
HydrogenBondAcceptorCount
4
HydrogenBondDonorCount
2
RotatableBondCount
3
Xlogp3
0.2
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CatalogNumber: AB50646
ChemicalName: Ethyl 5-hydroxy-1H-pyrazole-3-carboxylate
CasNumber: 85230-37-1
MolecularFormula: C6H8N2O3
MolecularWeight: 156.1393
MdlNumber: MFCD09263987
Smiles: CCOC(=O)c1cc([nH]n1)O
Complexity: 222
Covalently-bondedUnitCount: 1
HeavyAtomCount: 11
HydrogenBondAcceptorCount: 4
HydrogenBondDonorCount: 2
RotatableBondCount: 3
Xlogp3: 0.2
CatalogNumber:
AB50646
ChemicalName:
Ethyl 5-hydroxy-1H-pyrazole-3-carboxylate
CasNumber:
85230-37-1
MolecularFormula:
C6H8N2O3
MolecularWeight:
156.1393
MdlNumber:
MFCD09263987
Smiles:
CCOC(=O)c1cc([nH]n1)O
Complexity:
222
Covalently-bondedUnitCount:
1
HeavyAtomCount:
11
HydrogenBondAcceptorCount:
4
HydrogenBondDonorCount:
2
RotatableBondCount:
3
Xlogp3:
0.2
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: CC(=O)C1=NCCC1
Complexity: __
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
HydrogenBondDonorCount: __
RotatableBondCount: __
Xlogp3: __
CatalogNumber:
__
ChemicalName:
__
CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
__
Smiles:
CC(=O)C1=NCCC1
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
HydrogenBondDonorCount:
__
RotatableBondCount:
__
Xlogp3:
__
CatalogNumber: AB50648
ChemicalName: 1-(2-Morpholinoethyl)-1H-pyrazole-4-boronic acid, pinacol ester
CasNumber: 864754-18-7
MolecularFormula: C15H26BN3O3
MolecularWeight: 307.1962
MdlNumber: MFCD08062342
Smiles: CC1(C)OB(OC1(C)C)c1cnn(c1)CCN1CCOCC1
Complexity: 372
Covalently-bondedUnitCount: 1
HeavyAtomCount: 22
HydrogenBondAcceptorCount: 5
HydrogenBondDonorCount: __
RotatableBondCount: 4
Xlogp3: __
CatalogNumber:
AB50648
ChemicalName:
1-(2-Morpholinoethyl)-1H-pyrazole-4-boronic acid, pinacol ester
CasNumber:
864754-18-7
MolecularFormula:
C15H26BN3O3
MolecularWeight:
307.1962
MdlNumber:
MFCD08062342
Smiles:
CC1(C)OB(OC1(C)C)c1cnn(c1)CCN1CCOCC1
Complexity:
372
Covalently-bondedUnitCount:
1
HeavyAtomCount:
22
HydrogenBondAcceptorCount:
5
HydrogenBondDonorCount:
__
RotatableBondCount:
4
Xlogp3:
__
CatalogNumber: AB50649
ChemicalName: 1-cyclopropylpiperidin-4-ol
CasNumber: 851847-62-6
MolecularFormula: C8H15NO
MolecularWeight: 141.2108
MdlNumber: MFCD16300762
Smiles: OC1CCN(CC1)C1CC1
Complexity: 114
Covalently-bondedUnitCount: 1
HeavyAtomCount: 10
HydrogenBondAcceptorCount: 2
HydrogenBondDonorCount: 1
RotatableBondCount: 1
Xlogp3: 0.7
CatalogNumber:
AB50649
ChemicalName:
1-cyclopropylpiperidin-4-ol
CasNumber:
851847-62-6
MolecularFormula:
C8H15NO
MolecularWeight:
141.2108
MdlNumber:
MFCD16300762
Smiles:
OC1CCN(CC1)C1CC1
Complexity:
114
Covalently-bondedUnitCount:
1
HeavyAtomCount:
10
HydrogenBondAcceptorCount:
2
HydrogenBondDonorCount:
1
RotatableBondCount:
1
Xlogp3:
0.7