AF87938
37910-11-5 | 5-(1,1'-Biphenyl-4-yl)thiophene-2-carboxylic acid
Manufacturer: A2B Chem
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CatalogNumber
AF87938
ChemicalName
5-(1,1'-Biphenyl-4-yl)thiophene-2-carboxylic acid
CasNumber
37910-11-5
MolecularFormula
C17H12O2S
MolecularWeight
280.341
MdlNumber
MFCD12407207
Smiles
OC(=O)c1ccc(s1)c1ccc(cc1)c1ccccc1
Complexity
330
Covalently-bondedUnitCount
1
HeavyAtomCount
20
HydrogenBondAcceptorCount
3
HydrogenBondDonorCount
1
RotatableBondCount
3
Xlogp3
4.8
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CatalogNumber: AF87938
ChemicalName: 5-(1,1'-Biphenyl-4-yl)thiophene-2-carboxylic acid
CasNumber: 37910-11-5
MolecularFormula: C17H12O2S
MolecularWeight: 280.341
MdlNumber: MFCD12407207
Smiles: OC(=O)c1ccc(s1)c1ccc(cc1)c1ccccc1
Complexity: 330
Covalently-bondedUnitCount: 1
HeavyAtomCount: 20
HydrogenBondAcceptorCount: 3
HydrogenBondDonorCount: 1
RotatableBondCount: 3
Xlogp3: 4.8
CatalogNumber:
AF87938
ChemicalName:
5-(1,1'-Biphenyl-4-yl)thiophene-2-carboxylic acid
CasNumber:
37910-11-5
MolecularFormula:
C17H12O2S
MolecularWeight:
280.341
MdlNumber:
MFCD12407207
Smiles:
OC(=O)c1ccc(s1)c1ccc(cc1)c1ccccc1
Complexity:
330
Covalently-bondedUnitCount:
1
HeavyAtomCount:
20
HydrogenBondAcceptorCount:
3
HydrogenBondDonorCount:
1
RotatableBondCount:
3
Xlogp3:
4.8
CatalogNumber: AF87939
ChemicalName: 2-Methoxy-4-phenylbenzaldehyde
CasNumber: 343603-82-7
MolecularFormula: C14H12O2
MolecularWeight: 212.2439
MdlNumber: MFCD04039097
Smiles: COc1cc(ccc1C=O)c1ccccc1
Complexity: 221
Covalently-bondedUnitCount: 1
HeavyAtomCount: 16
HydrogenBondAcceptorCount: 2
HydrogenBondDonorCount: __
RotatableBondCount: 3
Xlogp3: 3
CatalogNumber:
AF87939
ChemicalName:
2-Methoxy-4-phenylbenzaldehyde
CasNumber:
343603-82-7
MolecularFormula:
C14H12O2
MolecularWeight:
212.2439
MdlNumber:
MFCD04039097
Smiles:
COc1cc(ccc1C=O)c1ccccc1
Complexity:
221
Covalently-bondedUnitCount:
1
HeavyAtomCount:
16
HydrogenBondAcceptorCount:
2
HydrogenBondDonorCount:
__
RotatableBondCount:
3
Xlogp3:
3
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: N#Cc1ccc(cc1S(=O)(=O)Cl)Cl
Complexity: __
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
HydrogenBondDonorCount: __
RotatableBondCount: __
Xlogp3: __
CatalogNumber:
__
ChemicalName:
__
CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
__
Smiles:
N#Cc1ccc(cc1S(=O)(=O)Cl)Cl
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
HydrogenBondDonorCount:
__
RotatableBondCount:
__
Xlogp3:
__
CatalogNumber: AF87941
ChemicalName: 5-Chloro-2,3-dihydro-benzofuran-2-carboxylic acid
CasNumber: 34385-94-9
MolecularFormula: C9H7ClO3
MolecularWeight: 198.6031
MdlNumber: MFCD06753266
Smiles: OC(=O)C1Cc2c(O1)ccc(c2)Cl
Complexity: 219
Covalently-bondedUnitCount: 1
HeavyAtomCount: 13
HydrogenBondAcceptorCount: 3
HydrogenBondDonorCount: 1
RotatableBondCount: 1
Xlogp3: 2.1
CatalogNumber:
AF87941
ChemicalName:
5-Chloro-2,3-dihydro-benzofuran-2-carboxylic acid
CasNumber:
34385-94-9
MolecularFormula:
C9H7ClO3
MolecularWeight:
198.6031
MdlNumber:
MFCD06753266
Smiles:
OC(=O)C1Cc2c(O1)ccc(c2)Cl
Complexity:
219
Covalently-bondedUnitCount:
1
HeavyAtomCount:
13
HydrogenBondAcceptorCount:
3
HydrogenBondDonorCount:
1
RotatableBondCount:
1
Xlogp3:
2.1