AA91874
17357-74-3 | 1-(5-Methyl-1h-pyrazol-3-yl)ethanone
Manufacturer: A2B Chem
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CatalogNumber
AA91874
ChemicalName
1-(5-Methyl-1h-pyrazol-3-yl)ethanone
CasNumber
17357-74-3
MolecularFormula
C6H8N2O
MolecularWeight
124.1405
MdlNumber
MFCD13151910
Smiles
CC(=O)c1n[nH]c(c1)C
Complexity
124
Covalently-bondedUnitCount
1
HeavyAtomCount
9
HydrogenBondAcceptorCount
2
HydrogenBondDonorCount
1
RotatableBondCount
1
Xlogp3
0.6
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CatalogNumber: AA91874
ChemicalName: 1-(5-Methyl-1h-pyrazol-3-yl)ethanone
CasNumber: 17357-74-3
MolecularFormula: C6H8N2O
MolecularWeight: 124.1405
MdlNumber: MFCD13151910
Smiles: CC(=O)c1n[nH]c(c1)C
Complexity: 124
Covalently-bondedUnitCount: 1
HeavyAtomCount: 9
HydrogenBondAcceptorCount: 2
HydrogenBondDonorCount: 1
RotatableBondCount: 1
Xlogp3: 0.6
CatalogNumber:
AA91874
ChemicalName:
1-(5-Methyl-1h-pyrazol-3-yl)ethanone
CasNumber:
17357-74-3
MolecularFormula:
C6H8N2O
MolecularWeight:
124.1405
MdlNumber:
MFCD13151910
Smiles:
CC(=O)c1n[nH]c(c1)C
Complexity:
124
Covalently-bondedUnitCount:
1
HeavyAtomCount:
9
HydrogenBondAcceptorCount:
2
HydrogenBondDonorCount:
1
RotatableBondCount:
1
Xlogp3:
0.6
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: Cc1cccc(c1)OC(=O)c1ccco1
Complexity: __
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
HydrogenBondDonorCount: __
RotatableBondCount: __
Xlogp3: __
CatalogNumber:
__
ChemicalName:
__
CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
__
Smiles:
Cc1cccc(c1)OC(=O)c1ccco1
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
HydrogenBondDonorCount:
__
RotatableBondCount:
__
Xlogp3:
__
CatalogNumber: AA91882
ChemicalName: 3-Acetoxy-5-bromoindole
CasNumber: 17357-14-1
MolecularFormula: C10H8BrNO2
MolecularWeight: 254.08
MdlNumber: MFCD00037933
Smiles: CC(=O)Oc1c[nH]c2c1cc(Br)cc2
Complexity: 234
Covalently-bondedUnitCount: 1
HeavyAtomCount: 14
HydrogenBondAcceptorCount: 2
HydrogenBondDonorCount: 1
RotatableBondCount: 2
Xlogp3: 2.7
CatalogNumber:
AA91882
ChemicalName:
3-Acetoxy-5-bromoindole
CasNumber:
17357-14-1
MolecularFormula:
C10H8BrNO2
MolecularWeight:
254.08
MdlNumber:
MFCD00037933
Smiles:
CC(=O)Oc1c[nH]c2c1cc(Br)cc2
Complexity:
234
Covalently-bondedUnitCount:
1
HeavyAtomCount:
14
HydrogenBondAcceptorCount:
2
HydrogenBondDonorCount:
1
RotatableBondCount:
2
Xlogp3:
2.7
CatalogNumber: AA91885
ChemicalName: 1,4-Difluoro-2,3-dimethylbenzene
CasNumber: 1736-90-9
MolecularFormula: C8H8F2
MolecularWeight: 142.1459
MdlNumber: MFCD04973769
Smiles: Cc1c(F)ccc(c1C)F
Complexity: 99.8
Covalently-bondedUnitCount: 1
HeavyAtomCount: 10
HydrogenBondAcceptorCount: 2
HydrogenBondDonorCount: __
RotatableBondCount: __
Xlogp3: 2.9
CatalogNumber:
AA91885
ChemicalName:
1,4-Difluoro-2,3-dimethylbenzene
CasNumber:
1736-90-9
MolecularFormula:
C8H8F2
MolecularWeight:
142.1459
MdlNumber:
MFCD04973769
Smiles:
Cc1c(F)ccc(c1C)F
Complexity:
99.8
Covalently-bondedUnitCount:
1
HeavyAtomCount:
10
HydrogenBondAcceptorCount:
2
HydrogenBondDonorCount:
__
RotatableBondCount:
__
Xlogp3:
2.9