AF66557
34761-09-6 | Ethyl 3-aminobenzothiophene-2-carboxylate
Manufacturer: A2B Chem
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CatalogNumber
AF66557
ChemicalName
Ethyl 3-aminobenzothiophene-2-carboxylate
CasNumber
34761-09-6
MolecularFormula
C11H11NO2S
MolecularWeight
221.2755
MdlNumber
MFCD00661903
Smiles
CCOC(=O)c1sc2c(c1N)cccc2
Complexity
247
Covalently-bondedUnitCount
1
HeavyAtomCount
15
HydrogenBondAcceptorCount
4
HydrogenBondDonorCount
1
RotatableBondCount
3
Xlogp3
3.4
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CatalogNumber: AF66557
ChemicalName: Ethyl 3-aminobenzothiophene-2-carboxylate
CasNumber: 34761-09-6
MolecularFormula: C11H11NO2S
MolecularWeight: 221.2755
MdlNumber: MFCD00661903
Smiles: CCOC(=O)c1sc2c(c1N)cccc2
Complexity: 247
Covalently-bondedUnitCount: 1
HeavyAtomCount: 15
HydrogenBondAcceptorCount: 4
HydrogenBondDonorCount: 1
RotatableBondCount: 3
Xlogp3: 3.4
CatalogNumber:
AF66557
ChemicalName:
Ethyl 3-aminobenzothiophene-2-carboxylate
CasNumber:
34761-09-6
MolecularFormula:
C11H11NO2S
MolecularWeight:
221.2755
MdlNumber:
MFCD00661903
Smiles:
CCOC(=O)c1sc2c(c1N)cccc2
Complexity:
247
Covalently-bondedUnitCount:
1
HeavyAtomCount:
15
HydrogenBondAcceptorCount:
4
HydrogenBondDonorCount:
1
RotatableBondCount:
3
Xlogp3:
3.4
CatalogNumber: AF66558
ChemicalName: Methyl 4-iodo-3-methoxybenzoate
CasNumber: 35387-92-9
MolecularFormula: C9H9IO3
MolecularWeight: 292.0704
MdlNumber: MFCD07367493
Smiles: COC(=O)c1ccc(c(c1)OC)I
Complexity: 184
Covalently-bondedUnitCount: 1
HeavyAtomCount: 13
HydrogenBondAcceptorCount: 3
HydrogenBondDonorCount: __
RotatableBondCount: 3
Xlogp3: 2.4
CatalogNumber:
AF66558
ChemicalName:
Methyl 4-iodo-3-methoxybenzoate
CasNumber:
35387-92-9
MolecularFormula:
C9H9IO3
MolecularWeight:
292.0704
MdlNumber:
MFCD07367493
Smiles:
COC(=O)c1ccc(c(c1)OC)I
Complexity:
184
Covalently-bondedUnitCount:
1
HeavyAtomCount:
13
HydrogenBondAcceptorCount:
3
HydrogenBondDonorCount:
__
RotatableBondCount:
3
Xlogp3:
2.4
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: Cc1c(C)ncnc1O
Complexity: __
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
HydrogenBondDonorCount: __
RotatableBondCount: __
Xlogp3: __
CatalogNumber:
__
ChemicalName:
__
CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
__
Smiles:
Cc1c(C)ncnc1O
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
HydrogenBondDonorCount:
__
RotatableBondCount:
__
Xlogp3:
__
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: __
Complexity: __
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
HydrogenBondDonorCount: __
RotatableBondCount: __
Xlogp3: __
CatalogNumber:
__
ChemicalName:
__
CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
__
Smiles:
__
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
HydrogenBondDonorCount:
__
RotatableBondCount:
__
Xlogp3:
__