AI14800
1226205-48-6 | 2-(o-tolyl)Nicotinic acid
Manufacturer: A2B Chem
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CatalogNumber
AI14800
ChemicalName
2-(o-tolyl)Nicotinic acid
CasNumber
1226205-48-6
MolecularFormula
C13H11NO2
MolecularWeight
213.2319
MdlNumber
MFCD16308579
Smiles
OC(=O)c1cccnc1c1ccccc1C
Complexity
254
Covalently-bondedUnitCount
1
HeavyAtomCount
16
HydrogenBondAcceptorCount
3
HydrogenBondDonorCount
1
RotatableBondCount
2
Xlogp3
2.4
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CatalogNumber: AI14800
ChemicalName: 2-(o-tolyl)Nicotinic acid
CasNumber: 1226205-48-6
MolecularFormula: C13H11NO2
MolecularWeight: 213.2319
MdlNumber: MFCD16308579
Smiles: OC(=O)c1cccnc1c1ccccc1C
Complexity: 254
Covalently-bondedUnitCount: 1
HeavyAtomCount: 16
HydrogenBondAcceptorCount: 3
HydrogenBondDonorCount: 1
RotatableBondCount: 2
Xlogp3: 2.4
CatalogNumber:
AI14800
ChemicalName:
2-(o-tolyl)Nicotinic acid
CasNumber:
1226205-48-6
MolecularFormula:
C13H11NO2
MolecularWeight:
213.2319
MdlNumber:
MFCD16308579
Smiles:
OC(=O)c1cccnc1c1ccccc1C
Complexity:
254
Covalently-bondedUnitCount:
1
HeavyAtomCount:
16
HydrogenBondAcceptorCount:
3
HydrogenBondDonorCount:
1
RotatableBondCount:
2
Xlogp3:
2.4
CatalogNumber: AI14801
ChemicalName: 2-(p-Tolyl)nicotinic acid
CasNumber: 1226205-68-0
MolecularFormula: C13H11NO2
MolecularWeight: 213.23193999999998
MdlNumber: MFCD16308585
Smiles: Cc1ccc(cc1)c1ncccc1C(=O)O
Complexity: 246
Covalently-bondedUnitCount: 1
HeavyAtomCount: 16
HydrogenBondAcceptorCount: 3
HydrogenBondDonorCount: 1
RotatableBondCount: 2
Xlogp3: 2.4
CatalogNumber:
AI14801
ChemicalName:
2-(p-Tolyl)nicotinic acid
CasNumber:
1226205-68-0
MolecularFormula:
C13H11NO2
MolecularWeight:
213.23193999999998
MdlNumber:
MFCD16308585
Smiles:
Cc1ccc(cc1)c1ncccc1C(=O)O
Complexity:
246
Covalently-bondedUnitCount:
1
HeavyAtomCount:
16
HydrogenBondAcceptorCount:
3
HydrogenBondDonorCount:
1
RotatableBondCount:
2
Xlogp3:
2.4
CatalogNumber: AI14802
ChemicalName: 2-(m-Tolyl)nicotinic acid
CasNumber: 1226205-71-5
MolecularFormula: C13H11NO2
MolecularWeight: 213.23193999999998
MdlNumber: MFCD16308582
Smiles: Cc1cccc(c1)c1ncccc1C(=O)O
Complexity: 254
Covalently-bondedUnitCount: 1
HeavyAtomCount: 16
HydrogenBondAcceptorCount: 3
HydrogenBondDonorCount: 1
RotatableBondCount: 2
Xlogp3: 2.4
CatalogNumber:
AI14802
ChemicalName:
2-(m-Tolyl)nicotinic acid
CasNumber:
1226205-71-5
MolecularFormula:
C13H11NO2
MolecularWeight:
213.23193999999998
MdlNumber:
MFCD16308582
Smiles:
Cc1cccc(c1)c1ncccc1C(=O)O
Complexity:
254
Covalently-bondedUnitCount:
1
HeavyAtomCount:
16
HydrogenBondAcceptorCount:
3
HydrogenBondDonorCount:
1
RotatableBondCount:
2
Xlogp3:
2.4
CatalogNumber: AI14803
ChemicalName: N-(2-Fluorophenyl)-1,3-propanesultam
CasNumber: 1226211-16-0
MolecularFormula: C9H10FNO2S
MolecularWeight: 215.2446
MdlNumber: MFCD16658879
Smiles: Fc1ccccc1N1CCCS1(=O)=O
Complexity: 298
Covalently-bondedUnitCount: 1
HeavyAtomCount: 14
HydrogenBondAcceptorCount: 4
HydrogenBondDonorCount: __
RotatableBondCount: 1
Xlogp3: 1.3
CatalogNumber:
AI14803
ChemicalName:
N-(2-Fluorophenyl)-1,3-propanesultam
CasNumber:
1226211-16-0
MolecularFormula:
C9H10FNO2S
MolecularWeight:
215.2446
MdlNumber:
MFCD16658879
Smiles:
Fc1ccccc1N1CCCS1(=O)=O
Complexity:
298
Covalently-bondedUnitCount:
1
HeavyAtomCount:
14
HydrogenBondAcceptorCount:
4
HydrogenBondDonorCount:
__
RotatableBondCount:
1
Xlogp3:
1.3