AA96944
181585-93-3 | Methyl 5-nitro-1h-pyrazole-3-carboxylate
Manufacturer: A2B Chem
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CatalogNumber
AA96944
ChemicalName
Methyl 5-nitro-1h-pyrazole-3-carboxylate
CasNumber
181585-93-3
MolecularFormula
C5H5N3O4
MolecularWeight
171.1109
MdlNumber
MFCD08236713
Smiles
[O-][N+](=O)c1cc(n[nH]1)C(=O)OC
Complexity
201
Covalently-bondedUnitCount
1
HeavyAtomCount
12
HydrogenBondAcceptorCount
5
HydrogenBondDonorCount
1
RotatableBondCount
2
Xlogp3
0.6
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CatalogNumber: AA96944
ChemicalName: Methyl 5-nitro-1h-pyrazole-3-carboxylate
CasNumber: 181585-93-3
MolecularFormula: C5H5N3O4
MolecularWeight: 171.1109
MdlNumber: MFCD08236713
Smiles: [O-][N+](=O)c1cc(n[nH]1)C(=O)OC
Complexity: 201
Covalently-bondedUnitCount: 1
HeavyAtomCount: 12
HydrogenBondAcceptorCount: 5
HydrogenBondDonorCount: 1
RotatableBondCount: 2
Xlogp3: 0.6
CatalogNumber:
AA96944
ChemicalName:
Methyl 5-nitro-1h-pyrazole-3-carboxylate
CasNumber:
181585-93-3
MolecularFormula:
C5H5N3O4
MolecularWeight:
171.1109
MdlNumber:
MFCD08236713
Smiles:
[O-][N+](=O)c1cc(n[nH]1)C(=O)OC
Complexity:
201
Covalently-bondedUnitCount:
1
HeavyAtomCount:
12
HydrogenBondAcceptorCount:
5
HydrogenBondDonorCount:
1
RotatableBondCount:
2
Xlogp3:
0.6
CatalogNumber: AA96947
ChemicalName: 4,5,6,7-Tetrahydro-1H-indazole HCl
CasNumber: 18161-11-0
MolecularFormula: C7H11ClN2
MolecularWeight: 158.6286
MdlNumber: MFCD13195636
Smiles: C1CCc2c(C1)[nH]nc2.Cl
Complexity: 103
Covalently-bondedUnitCount: 2
HeavyAtomCount: 10
HydrogenBondAcceptorCount: 1
HydrogenBondDonorCount: 2
RotatableBondCount: __
Xlogp3: __
CatalogNumber:
AA96947
ChemicalName:
4,5,6,7-Tetrahydro-1H-indazole HCl
CasNumber:
18161-11-0
MolecularFormula:
C7H11ClN2
MolecularWeight:
158.6286
MdlNumber:
MFCD13195636
Smiles:
C1CCc2c(C1)[nH]nc2.Cl
Complexity:
103
Covalently-bondedUnitCount:
2
HeavyAtomCount:
10
HydrogenBondAcceptorCount:
1
HydrogenBondDonorCount:
2
RotatableBondCount:
__
Xlogp3:
__
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: OCCc1c(C2CC2)n2n(c1=O)CCCC2
Complexity: __
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
HydrogenBondDonorCount: __
RotatableBondCount: __
Xlogp3: __
CatalogNumber:
__
ChemicalName:
__
CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
__
Smiles:
OCCc1c(C2CC2)n2n(c1=O)CCCC2
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
HydrogenBondDonorCount:
__
RotatableBondCount:
__
Xlogp3:
__
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: CC([SiH](C(C)(C)C)C(C)(C)C)(C)C
Complexity: __
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
HydrogenBondDonorCount: __
RotatableBondCount: __
Xlogp3: __
CatalogNumber:
__
ChemicalName:
__
CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
__
Smiles:
CC([SiH](C(C)(C)C)C(C)(C)C)(C)C
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
HydrogenBondDonorCount:
__
RotatableBondCount:
__
Xlogp3:
__