AI54846
67808-33-7 | Methyl 4-cyanothiophene-2-carboxylate
Manufacturer: A2B Chem
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CatalogNumber
AI54846
ChemicalName
Methyl 4-cyanothiophene-2-carboxylate
CasNumber
67808-33-7
MolecularFormula
C7H5NO2S
MolecularWeight
167.1851
MdlNumber
MFCD05664843
Smiles
COC(=O)c1cc(cs1)C#N
Complexity
208
Covalently-bondedUnitCount
1
HeavyAtomCount
11
HydrogenBondAcceptorCount
4
RotatableBondCount
2
Xlogp3
1.5
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CatalogNumber: AI54846
ChemicalName: Methyl 4-cyanothiophene-2-carboxylate
CasNumber: 67808-33-7
MolecularFormula: C7H5NO2S
MolecularWeight: 167.1851
MdlNumber: MFCD05664843
Smiles: COC(=O)c1cc(cs1)C#N
Complexity: 208
Covalently-bondedUnitCount: 1
HeavyAtomCount: 11
HydrogenBondAcceptorCount: 4
RotatableBondCount: 2
Xlogp3: 1.5
CatalogNumber:
AI54846
ChemicalName:
Methyl 4-cyanothiophene-2-carboxylate
CasNumber:
67808-33-7
MolecularFormula:
C7H5NO2S
MolecularWeight:
167.1851
MdlNumber:
MFCD05664843
Smiles:
COC(=O)c1cc(cs1)C#N
Complexity:
208
Covalently-bondedUnitCount:
1
HeavyAtomCount:
11
HydrogenBondAcceptorCount:
4
RotatableBondCount:
2
Xlogp3:
1.5
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: COC(=O)c1csc(c1)C=O
Complexity: __
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
RotatableBondCount: __
Xlogp3: __
CatalogNumber:
__
ChemicalName:
__
CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
__
Smiles:
COC(=O)c1csc(c1)C=O
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
RotatableBondCount:
__
Xlogp3:
__
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: Fc1c(F)c(F)c(c(c1I)F)I
Complexity: 152
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
RotatableBondCount: __
Xlogp3: 3.6
CatalogNumber:
__
ChemicalName:
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CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
__
Smiles:
Fc1c(F)c(F)c(c(c1I)F)I
Complexity:
152
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
RotatableBondCount:
__
Xlogp3:
3.6
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: N1CCC2C(C1)Oc1c2cccc1
Complexity: __
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
RotatableBondCount: __
Xlogp3: __
CatalogNumber:
__
ChemicalName:
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CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
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Smiles:
N1CCC2C(C1)Oc1c2cccc1
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
RotatableBondCount:
__
Xlogp3:
__