AA42942
127675-46-1 | 3-Chloro-2,4-difluorobenzaldehyde
Manufacturer: A2B Chem
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CatalogNumber
AA42942
ChemicalName
3-Chloro-2,4-difluorobenzaldehyde
CasNumber
127675-46-1
MolecularFormula
C7H3ClF2O
MolecularWeight
176.5479
MdlNumber
MFCD04116001
Smiles
O=Cc1ccc(c(c1F)Cl)F
Complexity
153
Covalently-bondedUnitCount
1
HeavyAtomCount
11
HydrogenBondAcceptorCount
3
RotatableBondCount
1
Xlogp3
2.2
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CatalogNumber: AA42942
ChemicalName: 3-Chloro-2,4-difluorobenzaldehyde
CasNumber: 127675-46-1
MolecularFormula: C7H3ClF2O
MolecularWeight: 176.5479
MdlNumber: MFCD04116001
Smiles: O=Cc1ccc(c(c1F)Cl)F
Complexity: 153
Covalently-bondedUnitCount: 1
HeavyAtomCount: 11
HydrogenBondAcceptorCount: 3
RotatableBondCount: 1
Xlogp3: 2.2
CatalogNumber:
AA42942
ChemicalName:
3-Chloro-2,4-difluorobenzaldehyde
CasNumber:
127675-46-1
MolecularFormula:
C7H3ClF2O
MolecularWeight:
176.5479
MdlNumber:
MFCD04116001
Smiles:
O=Cc1ccc(c(c1F)Cl)F
Complexity:
153
Covalently-bondedUnitCount:
1
HeavyAtomCount:
11
HydrogenBondAcceptorCount:
3
RotatableBondCount:
1
Xlogp3:
2.2
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MolecularFormula: __
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Smiles: N#COc1ccc(cc1)C(c1cccc(c1)C(c1ccc(cc1)OC#N)(C)C)(C)C
Complexity: __
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
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Xlogp3: __
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Smiles:
N#COc1ccc(cc1)C(c1cccc(c1)C(c1ccc(cc1)OC#N)(C)C)(C)C
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
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HydrogenBondAcceptorCount:
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RotatableBondCount:
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Xlogp3:
__
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Smiles: N#CC(c1ccccc1C(=O)c1ccccc1)c1ccccc1
Complexity: __
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Smiles:
N#CC(c1ccccc1C(=O)c1ccccc1)c1ccccc1
Complexity:
__
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__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
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RotatableBondCount:
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Smiles: CCON(C1=NC(=NC(=N1)NC2=CC(=C(C=C2)C=CC3=C(C=C(C=C3)NC4=NC(=NC(=N4)NC5=CC=CC=C5)N(OCC)OCC)S(=O)(=O)[O-])S(=O)(=O)[O-])NC6=CC=CC=C6)OCC.[Na+].[Na+]
Complexity: 1470
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
RotatableBondCount: __
Xlogp3: __
CatalogNumber:
__
ChemicalName:
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CasNumber:
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MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
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Smiles:
CCON(C1=NC(=NC(=N1)NC2=CC(=C(C=C2)C=CC3=C(C=C(C=C3)NC4=NC(=NC(=N4)NC5=CC=CC=C5)N(OCC)OCC)S(=O)(=O)[O-])S(=O)(=O)[O-])NC6=CC=CC=C6)OCC.[Na+].[Na+]
Complexity:
1470
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
RotatableBondCount:
__
Xlogp3:
__