AD98907
82668-50-6 | (1H-Pyrazol-3-yl)acetic acid ethyl ester
Manufacturer: A2B Chem
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CatalogNumber
AD98907
ChemicalName
(1H-Pyrazol-3-yl)acetic acid ethyl ester
CasNumber
82668-50-6
MolecularFormula
C7H10N2O2
MolecularWeight
154.1665
MdlNumber
MFCD11036165
Smiles
CCOC(=O)Cc1cc[nH]n1
Complexity
138
Covalently-bondedUnitCount
1
HeavyAtomCount
11
HydrogenBondAcceptorCount
3
HydrogenBondDonorCount
1
RotatableBondCount
4
Xlogp3
0.4
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CatalogNumber: AD98907
ChemicalName: (1H-Pyrazol-3-yl)acetic acid ethyl ester
CasNumber: 82668-50-6
MolecularFormula: C7H10N2O2
MolecularWeight: 154.1665
MdlNumber: MFCD11036165
Smiles: CCOC(=O)Cc1cc[nH]n1
Complexity: 138
Covalently-bondedUnitCount: 1
HeavyAtomCount: 11
HydrogenBondAcceptorCount: 3
HydrogenBondDonorCount: 1
RotatableBondCount: 4
Xlogp3: 0.4
CatalogNumber:
AD98907
ChemicalName:
(1H-Pyrazol-3-yl)acetic acid ethyl ester
CasNumber:
82668-50-6
MolecularFormula:
C7H10N2O2
MolecularWeight:
154.1665
MdlNumber:
MFCD11036165
Smiles:
CCOC(=O)Cc1cc[nH]n1
Complexity:
138
Covalently-bondedUnitCount:
1
HeavyAtomCount:
11
HydrogenBondAcceptorCount:
3
HydrogenBondDonorCount:
1
RotatableBondCount:
4
Xlogp3:
0.4
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: OCc1ccccc1OC(C)C
Complexity: __
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
HydrogenBondDonorCount: __
RotatableBondCount: __
Xlogp3: __
CatalogNumber:
__
ChemicalName:
__
CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
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Smiles:
OCc1ccccc1OC(C)C
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
HydrogenBondDonorCount:
__
RotatableBondCount:
__
Xlogp3:
__
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ChemicalName: __
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MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: OCCC(OCC)C
Complexity: __
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HydrogenBondAcceptorCount: __
HydrogenBondDonorCount: __
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Xlogp3: __
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ChemicalName:
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MolecularFormula:
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MolecularWeight:
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MdlNumber:
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Smiles:
OCCC(OCC)C
Complexity:
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Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
HydrogenBondDonorCount:
__
RotatableBondCount:
__
Xlogp3:
__
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ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
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Smiles: OS(=O)(=O)c1cc(c2c3c1NS(=O)(=O)c3ccc2)S(=O)(=O)O
Complexity: __
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
HydrogenBondDonorCount: __
RotatableBondCount: __
Xlogp3: __
CatalogNumber:
__
ChemicalName:
__
CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
__
Smiles:
OS(=O)(=O)c1cc(c2c3c1NS(=O)(=O)c3ccc2)S(=O)(=O)O
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
HydrogenBondDonorCount:
__
RotatableBondCount:
__
Xlogp3:
__