AB73847
10602-03-6 | Ethyl 4-ethynylbenzoate
Manufacturer: A2B Chem
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CatalogNumber
AB73847
ChemicalName
Ethyl 4-ethynylbenzoate
CasNumber
10602-03-6
MolecularFormula
C11H10O2
MolecularWeight
174.1959
MdlNumber
MFCD00168821
Smiles
CCOC(=O)c1ccc(cc1)C#C
Complexity
216
Covalently-bondedUnitCount
1
HeavyAtomCount
13
HydrogenBondAcceptorCount
2
RotatableBondCount
4
Xlogp3
2.9
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CatalogNumber: AB73847
ChemicalName: Ethyl 4-ethynylbenzoate
CasNumber: 10602-03-6
MolecularFormula: C11H10O2
MolecularWeight: 174.1959
MdlNumber: MFCD00168821
Smiles: CCOC(=O)c1ccc(cc1)C#C
Complexity: 216
Covalently-bondedUnitCount: 1
HeavyAtomCount: 13
HydrogenBondAcceptorCount: 2
RotatableBondCount: 4
Xlogp3: 2.9
CatalogNumber:
AB73847
ChemicalName:
Ethyl 4-ethynylbenzoate
CasNumber:
10602-03-6
MolecularFormula:
C11H10O2
MolecularWeight:
174.1959
MdlNumber:
MFCD00168821
Smiles:
CCOC(=O)c1ccc(cc1)C#C
Complexity:
216
Covalently-bondedUnitCount:
1
HeavyAtomCount:
13
HydrogenBondAcceptorCount:
2
RotatableBondCount:
4
Xlogp3:
2.9
CatalogNumber: AB73848
ChemicalName: Ethyl 4-fluoropiperidine-4-carboxylate, HCl
CasNumber: 845909-49-1
MolecularFormula: C8H15ClFNO2
MolecularWeight: 211.6616
MdlNumber: MFCD09880187
Smiles: CCOC(=O)C1(F)CCNCC1.Cl
Complexity: 166
Covalently-bondedUnitCount: 2
HeavyAtomCount: 13
HydrogenBondAcceptorCount: 4
RotatableBondCount: 3
Xlogp3: __
CatalogNumber:
AB73848
ChemicalName:
Ethyl 4-fluoropiperidine-4-carboxylate, HCl
CasNumber:
845909-49-1
MolecularFormula:
C8H15ClFNO2
MolecularWeight:
211.6616
MdlNumber:
MFCD09880187
Smiles:
CCOC(=O)C1(F)CCNCC1.Cl
Complexity:
166
Covalently-bondedUnitCount:
2
HeavyAtomCount:
13
HydrogenBondAcceptorCount:
4
RotatableBondCount:
3
Xlogp3:
__
CatalogNumber: AB73849
ChemicalName: ethyl 4-hydroxypiperidine-1-carboxylate
CasNumber: 65214-82-6
MolecularFormula: C8H15NO3
MolecularWeight: 173.2096
MdlNumber: MFCD00086880
Smiles: CCOC(=O)N1CCC(CC1)O
Complexity: 152
Covalently-bondedUnitCount: 1
HeavyAtomCount: 12
HydrogenBondAcceptorCount: 3
RotatableBondCount: 2
Xlogp3: 0.4
CatalogNumber:
AB73849
ChemicalName:
ethyl 4-hydroxypiperidine-1-carboxylate
CasNumber:
65214-82-6
MolecularFormula:
C8H15NO3
MolecularWeight:
173.2096
MdlNumber:
MFCD00086880
Smiles:
CCOC(=O)N1CCC(CC1)O
Complexity:
152
Covalently-bondedUnitCount:
1
HeavyAtomCount:
12
HydrogenBondAcceptorCount:
3
RotatableBondCount:
2
Xlogp3:
0.4
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: CCOC(=O)c1cnc(nc1O)S(=O)(=O)C
Complexity: __
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
RotatableBondCount: __
Xlogp3: __
CatalogNumber:
__
ChemicalName:
__
CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
__
Smiles:
CCOC(=O)c1cnc(nc1O)S(=O)(=O)C
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
RotatableBondCount:
__
Xlogp3:
__