AF68466
32710-88-6 | (3,5-Dimethyl-1-phenyl-1h-pyrazol-4-yl)acetic acid
Manufacturer: A2B Chem
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CatalogNumber
AF68466
ChemicalName
(3,5-Dimethyl-1-phenyl-1h-pyrazol-4-yl)acetic acid
CasNumber
32710-88-6
MolecularFormula
C13H14N2O2
MolecularWeight
230.2625
MdlNumber
MFCD00475550
Smiles
OC(=O)Cc1c(C)nn(c1C)c1ccccc1
Complexity
277
Covalently-bondedUnitCount
1
HeavyAtomCount
17
HydrogenBondAcceptorCount
3
HydrogenBondDonorCount
1
RotatableBondCount
3
Xlogp3
2.2
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CatalogNumber: AF68466
ChemicalName: (3,5-Dimethyl-1-phenyl-1h-pyrazol-4-yl)acetic acid
CasNumber: 32710-88-6
MolecularFormula: C13H14N2O2
MolecularWeight: 230.2625
MdlNumber: MFCD00475550
Smiles: OC(=O)Cc1c(C)nn(c1C)c1ccccc1
Complexity: 277
Covalently-bondedUnitCount: 1
HeavyAtomCount: 17
HydrogenBondAcceptorCount: 3
HydrogenBondDonorCount: 1
RotatableBondCount: 3
Xlogp3: 2.2
CatalogNumber:
AF68466
ChemicalName:
(3,5-Dimethyl-1-phenyl-1h-pyrazol-4-yl)acetic acid
CasNumber:
32710-88-6
MolecularFormula:
C13H14N2O2
MolecularWeight:
230.2625
MdlNumber:
MFCD00475550
Smiles:
OC(=O)Cc1c(C)nn(c1C)c1ccccc1
Complexity:
277
Covalently-bondedUnitCount:
1
HeavyAtomCount:
17
HydrogenBondAcceptorCount:
3
HydrogenBondDonorCount:
1
RotatableBondCount:
3
Xlogp3:
2.2
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
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Smiles: O(CCOCC1OC1)CCOCC1OC1
Complexity: __
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HeavyAtomCount: __
HydrogenBondAcceptorCount: __
HydrogenBondDonorCount: __
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Xlogp3: __
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Smiles:
O(CCOCC1OC1)CCOCC1OC1
Complexity:
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RotatableBondCount:
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Smiles: CC(Cc1ccc(cc1)C(C(=O)Cl)C)C
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CC(Cc1ccc(cc1)C(C(=O)Cl)C)C
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HeavyAtomCount:
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HydrogenBondAcceptorCount:
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RotatableBondCount:
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Smiles: __
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Covalently-bondedUnitCount: __
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HydrogenBondAcceptorCount: __
HydrogenBondDonorCount: __
RotatableBondCount: __
Xlogp3: __
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CasNumber:
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MolecularFormula:
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MolecularWeight:
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MdlNumber:
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Smiles:
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Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
HydrogenBondDonorCount:
__
RotatableBondCount:
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Xlogp3:
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