AD83080
89260-46-8 | 3-(1H-Pyrazol-3-yl)aniline
Manufacturer: A2B Chem
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CatalogNumber
AD83080
ChemicalName
3-(1H-Pyrazol-3-yl)aniline
CasNumber
89260-46-8
MolecularFormula
C9H9N3
MolecularWeight
159.1879
MdlNumber
MFCD00665959
Smiles
Nc1cccc(c1)c1n[nH]cc1
Complexity
149
Covalently-bondedUnitCount
1
HeavyAtomCount
12
HydrogenBondAcceptorCount
2
HydrogenBondDonorCount
2
RotatableBondCount
1
Xlogp3
1.2
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CatalogNumber: AD83080
ChemicalName: 3-(1H-Pyrazol-3-yl)aniline
CasNumber: 89260-46-8
MolecularFormula: C9H9N3
MolecularWeight: 159.1879
MdlNumber: MFCD00665959
Smiles: Nc1cccc(c1)c1n[nH]cc1
Complexity: 149
Covalently-bondedUnitCount: 1
HeavyAtomCount: 12
HydrogenBondAcceptorCount: 2
HydrogenBondDonorCount: 2
RotatableBondCount: 1
Xlogp3: 1.2
CatalogNumber:
AD83080
ChemicalName:
3-(1H-Pyrazol-3-yl)aniline
CasNumber:
89260-46-8
MolecularFormula:
C9H9N3
MolecularWeight:
159.1879
MdlNumber:
MFCD00665959
Smiles:
Nc1cccc(c1)c1n[nH]cc1
Complexity:
149
Covalently-bondedUnitCount:
1
HeavyAtomCount:
12
HydrogenBondAcceptorCount:
2
HydrogenBondDonorCount:
2
RotatableBondCount:
1
Xlogp3:
1.2
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: COC(=O)c1ncsc1S(=O)(=O)N
Complexity: __
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
HydrogenBondDonorCount: __
RotatableBondCount: __
Xlogp3: __
CatalogNumber:
__
ChemicalName:
__
CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
__
Smiles:
COC(=O)c1ncsc1S(=O)(=O)N
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
HydrogenBondDonorCount:
__
RotatableBondCount:
__
Xlogp3:
__
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: NS(=O)(=O)c1ncsc1
Complexity: __
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
HydrogenBondDonorCount: __
RotatableBondCount: __
Xlogp3: __
CatalogNumber:
__
ChemicalName:
__
CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
__
Smiles:
NS(=O)(=O)c1ncsc1
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
HydrogenBondDonorCount:
__
RotatableBondCount:
__
Xlogp3:
__
CatalogNumber: AD83086
ChemicalName: 1,3-Dimethyl-1H-pyrazole-4-sulfonyl chloride
CasNumber: 89501-93-9
MolecularFormula: C5H7ClN2O2S
MolecularWeight: 194.6393
MdlNumber: MFCD03944999
Smiles: Cn1nc(c(c1)S(=O)(=O)Cl)C
Complexity: 235
Covalently-bondedUnitCount: 1
HeavyAtomCount: 11
HydrogenBondAcceptorCount: 3
HydrogenBondDonorCount: __
RotatableBondCount: 1
Xlogp3: 0.7
CatalogNumber:
AD83086
ChemicalName:
1,3-Dimethyl-1H-pyrazole-4-sulfonyl chloride
CasNumber:
89501-93-9
MolecularFormula:
C5H7ClN2O2S
MolecularWeight:
194.6393
MdlNumber:
MFCD03944999
Smiles:
Cn1nc(c(c1)S(=O)(=O)Cl)C
Complexity:
235
Covalently-bondedUnitCount:
1
HeavyAtomCount:
11
HydrogenBondAcceptorCount:
3
HydrogenBondDonorCount:
__
RotatableBondCount:
1
Xlogp3:
0.7