AB64130
3553-12-6 | 3-Acetylaminopyrazole
Manufacturer: A2B Chem
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CatalogNumber
AB64130
ChemicalName
3-Acetylaminopyrazole
CasNumber
3553-12-6
MolecularFormula
C5H7N3O
MolecularWeight
125.1286
MdlNumber
MFCD09702442
Smiles
CC(=O)Nc1cc[nH]n1
Complexity
115
Covalently-bondedUnitCount
1
HeavyAtomCount
9
HydrogenBondAcceptorCount
2
HydrogenBondDonorCount
2
RotatableBondCount
1
Xlogp3
-0.3
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CatalogNumber: AB64130
ChemicalName: 3-Acetylaminopyrazole
CasNumber: 3553-12-6
MolecularFormula: C5H7N3O
MolecularWeight: 125.1286
MdlNumber: MFCD09702442
Smiles: CC(=O)Nc1cc[nH]n1
Complexity: 115
Covalently-bondedUnitCount: 1
HeavyAtomCount: 9
HydrogenBondAcceptorCount: 2
HydrogenBondDonorCount: 2
RotatableBondCount: 1
Xlogp3: -0.3
CatalogNumber:
AB64130
ChemicalName:
3-Acetylaminopyrazole
CasNumber:
3553-12-6
MolecularFormula:
C5H7N3O
MolecularWeight:
125.1286
MdlNumber:
MFCD09702442
Smiles:
CC(=O)Nc1cc[nH]n1
Complexity:
115
Covalently-bondedUnitCount:
1
HeavyAtomCount:
9
HydrogenBondAcceptorCount:
2
HydrogenBondDonorCount:
2
RotatableBondCount:
1
Xlogp3:
-0.3
CatalogNumber: AB64131
ChemicalName: 3-Acetamidopyridine
CasNumber: 5867-45-8
MolecularFormula: C7H8N2O
MolecularWeight: 136.1512
MdlNumber: MFCD00234323
Smiles: CC(=O)Nc1cccnc1
Complexity: 125
Covalently-bondedUnitCount: 1
HeavyAtomCount: 10
HydrogenBondAcceptorCount: 2
HydrogenBondDonorCount: 1
RotatableBondCount: 1
Xlogp3: 0.4
CatalogNumber:
AB64131
ChemicalName:
3-Acetamidopyridine
CasNumber:
5867-45-8
MolecularFormula:
C7H8N2O
MolecularWeight:
136.1512
MdlNumber:
MFCD00234323
Smiles:
CC(=O)Nc1cccnc1
Complexity:
125
Covalently-bondedUnitCount:
1
HeavyAtomCount:
10
HydrogenBondAcceptorCount:
2
HydrogenBondDonorCount:
1
RotatableBondCount:
1
Xlogp3:
0.4
CatalogNumber: AB64132
ChemicalName: 3-Oxobutan-2-yl acetate
CasNumber: 4906-24-5
MolecularFormula: C6H10O3
MolecularWeight: 130.1418
MdlNumber: MFCD00051782
Smiles: CC(=O)OC(C(=O)C)C
Complexity: __
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
HydrogenBondDonorCount: __
RotatableBondCount: __
Xlogp3: __
CatalogNumber:
AB64132
ChemicalName:
3-Oxobutan-2-yl acetate
CasNumber:
4906-24-5
MolecularFormula:
C6H10O3
MolecularWeight:
130.1418
MdlNumber:
MFCD00051782
Smiles:
CC(=O)OC(C(=O)C)C
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
HydrogenBondDonorCount:
__
RotatableBondCount:
__
Xlogp3:
__
CatalogNumber: AB64133
ChemicalName: 5-Formyl-2-methoxyphenyl acetate
CasNumber: 881-57-2
MolecularFormula: C10H10O4
MolecularWeight: 194.184
MdlNumber: MFCD00266441
Smiles: COc1ccc(cc1OC(=O)C)C=O
Complexity: 214
Covalently-bondedUnitCount: 1
HeavyAtomCount: 14
HydrogenBondAcceptorCount: 4
HydrogenBondDonorCount: __
RotatableBondCount: 4
Xlogp3: 0.8
CatalogNumber:
AB64133
ChemicalName:
5-Formyl-2-methoxyphenyl acetate
CasNumber:
881-57-2
MolecularFormula:
C10H10O4
MolecularWeight:
194.184
MdlNumber:
MFCD00266441
Smiles:
COc1ccc(cc1OC(=O)C)C=O
Complexity:
214
Covalently-bondedUnitCount:
1
HeavyAtomCount:
14
HydrogenBondAcceptorCount:
4
HydrogenBondDonorCount:
__
RotatableBondCount:
4
Xlogp3:
0.8