AI58362
873006-01-0 | 2-Iodo-4-(trifluoromethyl)benzaldehyde
Manufacturer: A2B Chem
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CatalogNumber
AI58362
ChemicalName
2-Iodo-4-(trifluoromethyl)benzaldehyde
CasNumber
873006-01-0
MolecularFormula
C8H4F3IO
MolecularWeight
300.0164
MdlNumber
MFCD18398121
Smiles
O=Cc1ccc(cc1I)C(F)(F)F
Complexity
192
Covalently-bondedUnitCount
1
HeavyAtomCount
13
HydrogenBondAcceptorCount
4
RotatableBondCount
1
Xlogp3
2.9
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CatalogNumber: AI58362
ChemicalName: 2-Iodo-4-(trifluoromethyl)benzaldehyde
CasNumber: 873006-01-0
MolecularFormula: C8H4F3IO
MolecularWeight: 300.0164
MdlNumber: MFCD18398121
Smiles: O=Cc1ccc(cc1I)C(F)(F)F
Complexity: 192
Covalently-bondedUnitCount: 1
HeavyAtomCount: 13
HydrogenBondAcceptorCount: 4
RotatableBondCount: 1
Xlogp3: 2.9
CatalogNumber:
AI58362
ChemicalName:
2-Iodo-4-(trifluoromethyl)benzaldehyde
CasNumber:
873006-01-0
MolecularFormula:
C8H4F3IO
MolecularWeight:
300.0164
MdlNumber:
MFCD18398121
Smiles:
O=Cc1ccc(cc1I)C(F)(F)F
Complexity:
192
Covalently-bondedUnitCount:
1
HeavyAtomCount:
13
HydrogenBondAcceptorCount:
4
RotatableBondCount:
1
Xlogp3:
2.9
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MolecularFormula: __
MolecularWeight: __
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Smiles: CCOC(=O)c1c[nH]c2c(c1=O)C(=O)CCC2
Complexity: __
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
RotatableBondCount: __
Xlogp3: __
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__
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MolecularFormula:
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Smiles:
CCOC(=O)c1c[nH]c2c(c1=O)C(=O)CCC2
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
RotatableBondCount:
__
Xlogp3:
__
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MolecularFormula: __
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Smiles: [O-][N+](=O)c1ccc2c(c1)[nH]c(c2)C(C)(C)C
Complexity: __
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
RotatableBondCount: __
Xlogp3: __
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__
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MolecularFormula:
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MolecularWeight:
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MdlNumber:
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Smiles:
[O-][N+](=O)c1ccc2c(c1)[nH]c(c2)C(C)(C)C
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
RotatableBondCount:
__
Xlogp3:
__
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Smiles: N1CCC2(CC1)CCNc1c2cccc1
Complexity: __
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HeavyAtomCount: __
HydrogenBondAcceptorCount: __
RotatableBondCount: __
Xlogp3: __
CatalogNumber:
__
ChemicalName:
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CasNumber:
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MolecularFormula:
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MolecularWeight:
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MdlNumber:
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Smiles:
N1CCC2(CC1)CCNc1c2cccc1
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
RotatableBondCount:
__
Xlogp3:
__