AB08492
199003-22-0 | 1-Boc-4-(hydroxymethyl)pyrazole
Manufacturer: A2B Chem
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CatalogNumber
AB08492
ChemicalName
1-Boc-4-(hydroxymethyl)pyrazole
CasNumber
199003-22-0
MolecularFormula
C9H14N2O3
MolecularWeight
198.2191
MdlNumber
MFCD24335255
Smiles
OCc1cnn(c1)C(=O)OC(C)(C)C
Complexity
213
Covalently-bondedUnitCount
1
HeavyAtomCount
14
HydrogenBondAcceptorCount
4
HydrogenBondDonorCount
1
RotatableBondCount
3
Xlogp3
0.6
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CatalogNumber: AB08492
ChemicalName: 1-Boc-4-(hydroxymethyl)pyrazole
CasNumber: 199003-22-0
MolecularFormula: C9H14N2O3
MolecularWeight: 198.2191
MdlNumber: MFCD24335255
Smiles: OCc1cnn(c1)C(=O)OC(C)(C)C
Complexity: 213
Covalently-bondedUnitCount: 1
HeavyAtomCount: 14
HydrogenBondAcceptorCount: 4
HydrogenBondDonorCount: 1
RotatableBondCount: 3
Xlogp3: 0.6
CatalogNumber:
AB08492
ChemicalName:
1-Boc-4-(hydroxymethyl)pyrazole
CasNumber:
199003-22-0
MolecularFormula:
C9H14N2O3
MolecularWeight:
198.2191
MdlNumber:
MFCD24335255
Smiles:
OCc1cnn(c1)C(=O)OC(C)(C)C
Complexity:
213
Covalently-bondedUnitCount:
1
HeavyAtomCount:
14
HydrogenBondAcceptorCount:
4
HydrogenBondDonorCount:
1
RotatableBondCount:
3
Xlogp3:
0.6
CatalogNumber: __
ChemicalName: __
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MolecularFormula: __
MolecularWeight: __
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Smiles: [2H]C(C=O)([2H])[2H]
Complexity: __
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
HydrogenBondDonorCount: __
RotatableBondCount: __
Xlogp3: __
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__
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__
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MolecularWeight:
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Smiles:
[2H]C(C=O)([2H])[2H]
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
HydrogenBondDonorCount:
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RotatableBondCount:
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Xlogp3:
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MolecularFormula: __
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Smiles: NC(=S)NN=C1CCCCC1=NNC(=S)N
Complexity: __
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HeavyAtomCount: __
HydrogenBondAcceptorCount: __
HydrogenBondDonorCount: __
RotatableBondCount: __
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__
ChemicalName:
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CasNumber:
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MolecularFormula:
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MolecularWeight:
__
MdlNumber:
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Smiles:
NC(=S)NN=C1CCCCC1=NNC(=S)N
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
HydrogenBondDonorCount:
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RotatableBondCount:
__
Xlogp3:
__
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Smiles: COCN=C=S
Complexity: __
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HeavyAtomCount: __
HydrogenBondAcceptorCount: __
HydrogenBondDonorCount: __
RotatableBondCount: __
Xlogp3: __
CatalogNumber:
__
ChemicalName:
__
CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
__
Smiles:
COCN=C=S
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
HydrogenBondDonorCount:
__
RotatableBondCount:
__
Xlogp3:
__