AA00912
1000895-25-9 | (5-Nitro-1h-pyrazol-3-yl)methanol
Manufacturer: A2B Chem
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CatalogNumber
AA00912
ChemicalName
(5-Nitro-1h-pyrazol-3-yl)methanol
CasNumber
1000895-25-9
MolecularFormula
C4H5N3O3
MolecularWeight
143.1008
MdlNumber
MFCD12025912
Smiles
OCc1n[nH]c(c1)[N+](=O)[O-]
Complexity
134
Covalently-bondedUnitCount
1
HeavyAtomCount
10
HydrogenBondAcceptorCount
4
HydrogenBondDonorCount
2
RotatableBondCount
1
Xlogp3
-0.5
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CatalogNumber: AA00912
ChemicalName: (5-Nitro-1h-pyrazol-3-yl)methanol
CasNumber: 1000895-25-9
MolecularFormula: C4H5N3O3
MolecularWeight: 143.1008
MdlNumber: MFCD12025912
Smiles: OCc1n[nH]c(c1)[N+](=O)[O-]
Complexity: 134
Covalently-bondedUnitCount: 1
HeavyAtomCount: 10
HydrogenBondAcceptorCount: 4
HydrogenBondDonorCount: 2
RotatableBondCount: 1
Xlogp3: -0.5
CatalogNumber:
AA00912
ChemicalName:
(5-Nitro-1h-pyrazol-3-yl)methanol
CasNumber:
1000895-25-9
MolecularFormula:
C4H5N3O3
MolecularWeight:
143.1008
MdlNumber:
MFCD12025912
Smiles:
OCc1n[nH]c(c1)[N+](=O)[O-]
Complexity:
134
Covalently-bondedUnitCount:
1
HeavyAtomCount:
10
HydrogenBondAcceptorCount:
4
HydrogenBondDonorCount:
2
RotatableBondCount:
1
Xlogp3:
-0.5
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: C[C@@H](c1c(F)cccc1Cl)N.Cl
Complexity: __
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
HydrogenBondDonorCount: __
RotatableBondCount: __
Xlogp3: __
CatalogNumber:
__
ChemicalName:
__
CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
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Smiles:
C[C@@H](c1c(F)cccc1Cl)N.Cl
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
HydrogenBondDonorCount:
__
RotatableBondCount:
__
Xlogp3:
__
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: CC(c1c(F)cccc1Cl)N
Complexity: __
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
HydrogenBondDonorCount: __
RotatableBondCount: __
Xlogp3: __
CatalogNumber:
__
ChemicalName:
__
CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
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Smiles:
CC(c1c(F)cccc1Cl)N
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
HydrogenBondDonorCount:
__
RotatableBondCount:
__
Xlogp3:
__
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: N[C@@H]1C[C@H]2N([C@@H]1CC2)C(=O)OC(C)(C)C
Complexity: __
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
HydrogenBondDonorCount: __
RotatableBondCount: __
Xlogp3: __
CatalogNumber:
__
ChemicalName:
__
CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
__
Smiles:
N[C@@H]1C[C@H]2N([C@@H]1CC2)C(=O)OC(C)(C)C
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
HydrogenBondDonorCount:
__
RotatableBondCount:
__
Xlogp3:
__