AY12574
1935294-81-7 | 2-Chloro-5-isopropoxy-3-nitropyridine
Manufacturer: A2B Chem
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CatalogNumber
AY12574
ChemicalName
2-Chloro-5-isopropoxy-3-nitropyridine
CasNumber
1935294-81-7
MolecularFormula
C8H9ClN2O3
MolecularWeight
216.6217
MdlNumber
MFCD29761895
Smiles
CC(Oc1cnc(c(c1)[N+](=O)[O-])Cl)C
Complexity
207
Covalently-bondedUnitCount
1
HeavyAtomCount
14
HydrogenBondAcceptorCount
4
RotatableBondCount
2
Xlogp3
2.4
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CatalogNumber: AY12574
ChemicalName: 2-Chloro-5-isopropoxy-3-nitropyridine
CasNumber: 1935294-81-7
MolecularFormula: C8H9ClN2O3
MolecularWeight: 216.6217
MdlNumber: MFCD29761895
Smiles: CC(Oc1cnc(c(c1)[N+](=O)[O-])Cl)C
Complexity: 207
Covalently-bondedUnitCount: 1
HeavyAtomCount: 14
HydrogenBondAcceptorCount: 4
RotatableBondCount: 2
Xlogp3: 2.4
CatalogNumber:
AY12574
ChemicalName:
2-Chloro-5-isopropoxy-3-nitropyridine
CasNumber:
1935294-81-7
MolecularFormula:
C8H9ClN2O3
MolecularWeight:
216.6217
MdlNumber:
MFCD29761895
Smiles:
CC(Oc1cnc(c(c1)[N+](=O)[O-])Cl)C
Complexity:
207
Covalently-bondedUnitCount:
1
HeavyAtomCount:
14
HydrogenBondAcceptorCount:
4
RotatableBondCount:
2
Xlogp3:
2.4
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: Brc1ccc(c(c1)OCc1ccccc1B1OC(C(O1)(C)C)(C)C)C
Complexity: 440
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
RotatableBondCount: __
Xlogp3: __
CatalogNumber:
__
ChemicalName:
__
CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
__
Smiles:
Brc1ccc(c(c1)OCc1ccccc1B1OC(C(O1)(C)C)(C)C)C
Complexity:
440
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
RotatableBondCount:
__
Xlogp3:
__
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: NC(=O)c1cnc2c(c1Nc1ccc(c(c1)C)C)ccc(c2)c1ccncc1
Complexity: 535
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
RotatableBondCount: __
Xlogp3: 4.4
CatalogNumber:
__
ChemicalName:
__
CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
__
Smiles:
NC(=O)c1cnc2c(c1Nc1ccc(c(c1)C)C)ccc(c2)c1ccncc1
Complexity:
535
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
RotatableBondCount:
__
Xlogp3:
4.4
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: CCC(=O)CCCCCCCCC(=O)O
Complexity: 187
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
RotatableBondCount: __
Xlogp3: 2.7
CatalogNumber:
__
ChemicalName:
__
CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
__
Smiles:
CCC(=O)CCCCCCCCC(=O)O
Complexity:
187
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
RotatableBondCount:
__
Xlogp3:
2.7