AI33215
13771-67-0 | Ethyl 5-chloro-1-benzothiophene-2-carboxylate
Manufacturer: A2B Chem
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CatalogNumber
AI33215
ChemicalName
Ethyl 5-chloro-1-benzothiophene-2-carboxylate
CasNumber
13771-67-0
MolecularFormula
C11H9ClO2S
MolecularWeight
240.706
MdlNumber
MFCD03069329
Smiles
CCOC(=O)c1cc2c(s1)ccc(c2)Cl
Complexity
247
Covalently-bondedUnitCount
1
HeavyAtomCount
15
HydrogenBondAcceptorCount
3
RotatableBondCount
3
Xlogp3
4.1
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CatalogNumber: AI33215
ChemicalName: Ethyl 5-chloro-1-benzothiophene-2-carboxylate
CasNumber: 13771-67-0
MolecularFormula: C11H9ClO2S
MolecularWeight: 240.706
MdlNumber: MFCD03069329
Smiles: CCOC(=O)c1cc2c(s1)ccc(c2)Cl
Complexity: 247
Covalently-bondedUnitCount: 1
HeavyAtomCount: 15
HydrogenBondAcceptorCount: 3
RotatableBondCount: 3
Xlogp3: 4.1
CatalogNumber:
AI33215
ChemicalName:
Ethyl 5-chloro-1-benzothiophene-2-carboxylate
CasNumber:
13771-67-0
MolecularFormula:
C11H9ClO2S
MolecularWeight:
240.706
MdlNumber:
MFCD03069329
Smiles:
CCOC(=O)c1cc2c(s1)ccc(c2)Cl
Complexity:
247
Covalently-bondedUnitCount:
1
HeavyAtomCount:
15
HydrogenBondAcceptorCount:
3
RotatableBondCount:
3
Xlogp3:
4.1
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Smiles: N#Cc1cc(F)cc2c1cccc2
Complexity: __
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HeavyAtomCount: __
HydrogenBondAcceptorCount: __
RotatableBondCount: __
Xlogp3: __
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__
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MolecularFormula:
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MolecularWeight:
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Smiles:
N#Cc1cc(F)cc2c1cccc2
Complexity:
__
Covalently-bondedUnitCount:
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HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
RotatableBondCount:
__
Xlogp3:
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Smiles: Brc1ccc(cc1)Oc1ccc(cn1)C(F)(F)F
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Smiles:
Brc1ccc(cc1)Oc1ccc(cn1)C(F)(F)F
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
RotatableBondCount:
__
Xlogp3:
__
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Smiles: COC(=O)c1cccc(c1O)NC(=O)c1ccccc1
Complexity: __
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
RotatableBondCount: __
Xlogp3: __
CatalogNumber:
__
ChemicalName:
__
CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
__
Smiles:
COC(=O)c1cccc(c1O)NC(=O)c1ccccc1
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
RotatableBondCount:
__
Xlogp3:
__