AG24519
54453-93-9 | Ethyl 2-chloroisonicotinate
Manufacturer: A2B Chem
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CatalogNumber
AG24519
ChemicalName
Ethyl 2-chloroisonicotinate
CasNumber
54453-93-9
MolecularFormula
C8H8ClNO2
MolecularWeight
185.6076
MdlNumber
MFCD04114259
Smiles
CCOC(=O)c1ccnc(c1)Cl
Complexity
163
Covalently-bondedUnitCount
1
HeavyAtomCount
12
HydrogenBondAcceptorCount
3
RotatableBondCount
3
Xlogp3
1.8
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CatalogNumber: AG24519
ChemicalName: Ethyl 2-chloroisonicotinate
CasNumber: 54453-93-9
MolecularFormula: C8H8ClNO2
MolecularWeight: 185.6076
MdlNumber: MFCD04114259
Smiles: CCOC(=O)c1ccnc(c1)Cl
Complexity: 163
Covalently-bondedUnitCount: 1
HeavyAtomCount: 12
HydrogenBondAcceptorCount: 3
RotatableBondCount: 3
Xlogp3: 1.8
CatalogNumber:
AG24519
ChemicalName:
Ethyl 2-chloroisonicotinate
CasNumber:
54453-93-9
MolecularFormula:
C8H8ClNO2
MolecularWeight:
185.6076
MdlNumber:
MFCD04114259
Smiles:
CCOC(=O)c1ccnc(c1)Cl
Complexity:
163
Covalently-bondedUnitCount:
1
HeavyAtomCount:
12
HydrogenBondAcceptorCount:
3
RotatableBondCount:
3
Xlogp3:
1.8
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: c1ccc(cc1)P([Ru+2](P(c1ccccc1)(c1ccccc1)c1ccccc1)P(c1ccccc1)(c1ccccc1)c1ccccc1)(c1ccccc1)c1ccccc1.[H-].[Cl-]
Complexity: __
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
RotatableBondCount: __
Xlogp3: __
CatalogNumber:
__
ChemicalName:
__
CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
__
Smiles:
c1ccc(cc1)P([Ru+2](P(c1ccccc1)(c1ccccc1)c1ccccc1)P(c1ccccc1)(c1ccccc1)c1ccccc1)(c1ccccc1)c1ccccc1.[H-].[Cl-]
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
RotatableBondCount:
__
Xlogp3:
__
CatalogNumber: AG24521
ChemicalName: 1-(5-Chloro-1h-indol-3-yl)ethanone
CasNumber: 51843-24-4
MolecularFormula: C10H8ClNO
MolecularWeight: 193.6296
MdlNumber: MFCD07437837
Smiles: Clc1ccc2c(c1)c(c[nH]2)C(=O)C
Complexity: __
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
RotatableBondCount: __
Xlogp3: __
CatalogNumber:
AG24521
ChemicalName:
1-(5-Chloro-1h-indol-3-yl)ethanone
CasNumber:
51843-24-4
MolecularFormula:
C10H8ClNO
MolecularWeight:
193.6296
MdlNumber:
MFCD07437837
Smiles:
Clc1ccc2c(c1)c(c[nH]2)C(=O)C
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
RotatableBondCount:
__
Xlogp3:
__
CatalogNumber: AG24522
ChemicalName: 3-(Pyridin-4-yl)benzoic acid
CasNumber: 4385-78-8
MolecularFormula: C12H9NO2
MolecularWeight: 199.20535999999996
MdlNumber: MFCD05864808
Smiles: OC(=O)c1cccc(c1)c1ccncc1
Complexity: 224
Covalently-bondedUnitCount: 1
HeavyAtomCount: 15
HydrogenBondAcceptorCount: 3
RotatableBondCount: 2
Xlogp3: 2.6
CatalogNumber:
AG24522
ChemicalName:
3-(Pyridin-4-yl)benzoic acid
CasNumber:
4385-78-8
MolecularFormula:
C12H9NO2
MolecularWeight:
199.20535999999996
MdlNumber:
MFCD05864808
Smiles:
OC(=O)c1cccc(c1)c1ccncc1
Complexity:
224
Covalently-bondedUnitCount:
1
HeavyAtomCount:
15
HydrogenBondAcceptorCount:
3
RotatableBondCount:
2
Xlogp3:
2.6