AB73873
40611-85-6 | 4-Methyl-2-pyrrolecarboxylic acid ethyl ester
Manufacturer: A2B Chem
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CatalogNumber
AB73873
ChemicalName
4-Methyl-2-pyrrolecarboxylic acid ethyl ester
CasNumber
40611-85-6
MolecularFormula
C8H11NO2
MolecularWeight
153.1784
MdlNumber
MFCD00191668
Smiles
CCOC(=O)c1[nH]cc(c1)C
Complexity
147
Covalently-bondedUnitCount
1
HeavyAtomCount
11
HydrogenBondAcceptorCount
2
HydrogenBondDonorCount
1
RotatableBondCount
3
Xlogp3
1.6
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CatalogNumber: AB73873
ChemicalName: 4-Methyl-2-pyrrolecarboxylic acid ethyl ester
CasNumber: 40611-85-6
MolecularFormula: C8H11NO2
MolecularWeight: 153.1784
MdlNumber: MFCD00191668
Smiles: CCOC(=O)c1[nH]cc(c1)C
Complexity: 147
Covalently-bondedUnitCount: 1
HeavyAtomCount: 11
HydrogenBondAcceptorCount: 2
HydrogenBondDonorCount: 1
RotatableBondCount: 3
Xlogp3: 1.6
CatalogNumber:
AB73873
ChemicalName:
4-Methyl-2-pyrrolecarboxylic acid ethyl ester
CasNumber:
40611-85-6
MolecularFormula:
C8H11NO2
MolecularWeight:
153.1784
MdlNumber:
MFCD00191668
Smiles:
CCOC(=O)c1[nH]cc(c1)C
Complexity:
147
Covalently-bondedUnitCount:
1
HeavyAtomCount:
11
HydrogenBondAcceptorCount:
2
HydrogenBondDonorCount:
1
RotatableBondCount:
3
Xlogp3:
1.6
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: CCOS(=O)(=O)c1ccc(cc1)C
Complexity: 232
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
HydrogenBondDonorCount: __
RotatableBondCount: __
Xlogp3: 1.8
CatalogNumber:
__
ChemicalName:
__
CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
__
Smiles:
CCOS(=O)(=O)c1ccc(cc1)C
Complexity:
232
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
HydrogenBondDonorCount:
__
RotatableBondCount:
__
Xlogp3:
1.8
CatalogNumber: AB73875
ChemicalName: Ethyl 4-methylpiperidine-4-carboxylate hydrochloride
CasNumber: 225240-71-1
MolecularFormula: C9H18ClNO2
MolecularWeight: 207.6977
MdlNumber: MFCD11045418
Smiles: CCOC(=O)C1(C)CCNCC1.Cl
Complexity: 162
Covalently-bondedUnitCount: 2
HeavyAtomCount: 13
HydrogenBondAcceptorCount: 3
HydrogenBondDonorCount: 2
RotatableBondCount: 3
Xlogp3: __
CatalogNumber:
AB73875
ChemicalName:
Ethyl 4-methylpiperidine-4-carboxylate hydrochloride
CasNumber:
225240-71-1
MolecularFormula:
C9H18ClNO2
MolecularWeight:
207.6977
MdlNumber:
MFCD11045418
Smiles:
CCOC(=O)C1(C)CCNCC1.Cl
Complexity:
162
Covalently-bondedUnitCount:
2
HeavyAtomCount:
13
HydrogenBondAcceptorCount:
3
HydrogenBondDonorCount:
2
RotatableBondCount:
3
Xlogp3:
__
CatalogNumber: AB73876
ChemicalName: Ethyl 4-methyl-1h-pyrazole-5-carboxylate
CasNumber: 6076-12-6
MolecularFormula: C7H10N2O2
MolecularWeight: 154.1665
MdlNumber: MFCD16619879
Smiles: CCOC(=O)c1n[nH]cc1C
Complexity: 149
Covalently-bondedUnitCount: 1
HeavyAtomCount: 11
HydrogenBondAcceptorCount: 3
HydrogenBondDonorCount: 1
RotatableBondCount: 3
Xlogp3: 1.1
CatalogNumber:
AB73876
ChemicalName:
Ethyl 4-methyl-1h-pyrazole-5-carboxylate
CasNumber:
6076-12-6
MolecularFormula:
C7H10N2O2
MolecularWeight:
154.1665
MdlNumber:
MFCD16619879
Smiles:
CCOC(=O)c1n[nH]cc1C
Complexity:
149
Covalently-bondedUnitCount:
1
HeavyAtomCount:
11
HydrogenBondAcceptorCount:
3
HydrogenBondDonorCount:
1
RotatableBondCount:
3
Xlogp3:
1.1