AD68099
1099632-00-4 | 5-(4-Chloro-2-methylphenyl)thiophene-2-carboxylic acid
Manufacturer: A2B Chem
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CatalogNumber
AD68099
ChemicalName
5-(4-Chloro-2-methylphenyl)thiophene-2-carboxylic acid
CasNumber
1099632-00-4
MolecularFormula
C12H9ClO2S
MolecularWeight
252.7167
MdlNumber
MFCD11650590
Smiles
Clc1ccc(c(c1)C)c1ccc(s1)C(=O)O
Complexity
272
Covalently-bondedUnitCount
1
HeavyAtomCount
16
HydrogenBondAcceptorCount
3
HydrogenBondDonorCount
1
RotatableBondCount
2
Xlogp3
4.1
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CatalogNumber: AD68099
ChemicalName: 5-(4-Chloro-2-methylphenyl)thiophene-2-carboxylic acid
CasNumber: 1099632-00-4
MolecularFormula: C12H9ClO2S
MolecularWeight: 252.7167
MdlNumber: MFCD11650590
Smiles: Clc1ccc(c(c1)C)c1ccc(s1)C(=O)O
Complexity: 272
Covalently-bondedUnitCount: 1
HeavyAtomCount: 16
HydrogenBondAcceptorCount: 3
HydrogenBondDonorCount: 1
RotatableBondCount: 2
Xlogp3: 4.1
CatalogNumber:
AD68099
ChemicalName:
5-(4-Chloro-2-methylphenyl)thiophene-2-carboxylic acid
CasNumber:
1099632-00-4
MolecularFormula:
C12H9ClO2S
MolecularWeight:
252.7167
MdlNumber:
MFCD11650590
Smiles:
Clc1ccc(c(c1)C)c1ccc(s1)C(=O)O
Complexity:
272
Covalently-bondedUnitCount:
1
HeavyAtomCount:
16
HydrogenBondAcceptorCount:
3
HydrogenBondDonorCount:
1
RotatableBondCount:
2
Xlogp3:
4.1
CatalogNumber: AD68100
ChemicalName: 4-Bromo-2-(diethylamino)benzaldehyde
CasNumber: 1099629-82-9
MolecularFormula: C11H14BrNO
MolecularWeight: 256.139
MdlNumber: MFCD11651738
Smiles: CCN(c1cc(Br)ccc1C=O)CC
Complexity: 182
Covalently-bondedUnitCount: 1
HeavyAtomCount: 14
HydrogenBondAcceptorCount: 2
HydrogenBondDonorCount: __
RotatableBondCount: 4
Xlogp3: 2.9
CatalogNumber:
AD68100
ChemicalName:
4-Bromo-2-(diethylamino)benzaldehyde
CasNumber:
1099629-82-9
MolecularFormula:
C11H14BrNO
MolecularWeight:
256.139
MdlNumber:
MFCD11651738
Smiles:
CCN(c1cc(Br)ccc1C=O)CC
Complexity:
182
Covalently-bondedUnitCount:
1
HeavyAtomCount:
14
HydrogenBondAcceptorCount:
2
HydrogenBondDonorCount:
__
RotatableBondCount:
4
Xlogp3:
2.9
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: OC(=O)Cc1ccc(cc1)S(=O)(=O)C(F)(F)F
Complexity: __
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
HydrogenBondDonorCount: __
RotatableBondCount: __
Xlogp3: __
CatalogNumber:
__
ChemicalName:
__
CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
__
Smiles:
OC(=O)Cc1ccc(cc1)S(=O)(=O)C(F)(F)F
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
HydrogenBondDonorCount:
__
RotatableBondCount:
__
Xlogp3:
__
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: COc1ccc2c(c1)C(N)CO2.Cl
Complexity: __
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
HydrogenBondDonorCount: __
RotatableBondCount: __
Xlogp3: __
CatalogNumber:
__
ChemicalName:
__
CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
__
Smiles:
COc1ccc2c(c1)C(N)CO2.Cl
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
HydrogenBondDonorCount:
__
RotatableBondCount:
__
Xlogp3:
__