AD63135
112779-14-3 | Ethyl 5-amino-1-tert-butylpyrazole-4-carboxylate
Manufacturer: A2B Chem
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CatalogNumber
AD63135
ChemicalName
Ethyl 5-amino-1-tert-butylpyrazole-4-carboxylate
CasNumber
112779-14-3
MolecularFormula
C10H17N3O2
MolecularWeight
211.2609
MdlNumber
MFCD06637286
Smiles
CCOC(=O)c1cnn(c1N)C(C)(C)C
Complexity
237
Covalently-bondedUnitCount
1
HeavyAtomCount
15
HydrogenBondAcceptorCount
4
HydrogenBondDonorCount
1
RotatableBondCount
4
Xlogp3
1.5
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CatalogNumber: AD63135
ChemicalName: Ethyl 5-amino-1-tert-butylpyrazole-4-carboxylate
CasNumber: 112779-14-3
MolecularFormula: C10H17N3O2
MolecularWeight: 211.2609
MdlNumber: MFCD06637286
Smiles: CCOC(=O)c1cnn(c1N)C(C)(C)C
Complexity: 237
Covalently-bondedUnitCount: 1
HeavyAtomCount: 15
HydrogenBondAcceptorCount: 4
HydrogenBondDonorCount: 1
RotatableBondCount: 4
Xlogp3: 1.5
CatalogNumber:
AD63135
ChemicalName:
Ethyl 5-amino-1-tert-butylpyrazole-4-carboxylate
CasNumber:
112779-14-3
MolecularFormula:
C10H17N3O2
MolecularWeight:
211.2609
MdlNumber:
MFCD06637286
Smiles:
CCOC(=O)c1cnn(c1N)C(C)(C)C
Complexity:
237
Covalently-bondedUnitCount:
1
HeavyAtomCount:
15
HydrogenBondAcceptorCount:
4
HydrogenBondDonorCount:
1
RotatableBondCount:
4
Xlogp3:
1.5
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: CN(C(=CC(=O)c1ccc(cc1)Cl)C)C
Complexity: __
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
HydrogenBondDonorCount: __
RotatableBondCount: __
Xlogp3: __
CatalogNumber:
__
ChemicalName:
__
CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
__
Smiles:
CN(C(=CC(=O)c1ccc(cc1)Cl)C)C
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
HydrogenBondDonorCount:
__
RotatableBondCount:
__
Xlogp3:
__
CatalogNumber: AD63153
ChemicalName: 7-Methyl-1H-indole-2,3-dione
CasNumber: 1127-59-9
MolecularFormula: C9H7NO2
MolecularWeight: 161.15737999999996
MdlNumber: MFCD00022797
Smiles: O=C1Nc2c(C1=O)cccc2C
Complexity: 237
Covalently-bondedUnitCount: 1
HeavyAtomCount: 12
HydrogenBondAcceptorCount: 2
HydrogenBondDonorCount: 1
RotatableBondCount: __
Xlogp3: 1.2
CatalogNumber:
AD63153
ChemicalName:
7-Methyl-1H-indole-2,3-dione
CasNumber:
1127-59-9
MolecularFormula:
C9H7NO2
MolecularWeight:
161.15737999999996
MdlNumber:
MFCD00022797
Smiles:
O=C1Nc2c(C1=O)cccc2C
Complexity:
237
Covalently-bondedUnitCount:
1
HeavyAtomCount:
12
HydrogenBondAcceptorCount:
2
HydrogenBondDonorCount:
1
RotatableBondCount:
__
Xlogp3:
1.2
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: N#CCC(=O)c1c(N)n(C)c(=O)n(c1=O)C
Complexity: __
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
HydrogenBondDonorCount: __
RotatableBondCount: __
Xlogp3: __
CatalogNumber:
__
ChemicalName:
__
CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
__
Smiles:
N#CCC(=O)c1c(N)n(C)c(=O)n(c1=O)C
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
HydrogenBondDonorCount:
__
RotatableBondCount:
__
Xlogp3:
__