AD40597
1113049-90-3 | 6-Chloro-5-(trifluoromethyl)nicotinaldehyde
Manufacturer: A2B Chem
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CatalogNumber
AD40597
ChemicalName
6-Chloro-5-(trifluoromethyl)nicotinaldehyde
CasNumber
1113049-90-3
MolecularFormula
C7H3ClF3NO
MolecularWeight
209.553
MdlNumber
MFCD18258310
Smiles
O=Cc1cnc(c(c1)C(F)(F)F)Cl
Complexity
197
Covalently-bondedUnitCount
1
HeavyAtomCount
13
HydrogenBondAcceptorCount
5
RotatableBondCount
1
Xlogp3
2.2
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CatalogNumber: AD40597
ChemicalName: 6-Chloro-5-(trifluoromethyl)nicotinaldehyde
CasNumber: 1113049-90-3
MolecularFormula: C7H3ClF3NO
MolecularWeight: 209.553
MdlNumber: MFCD18258310
Smiles: O=Cc1cnc(c(c1)C(F)(F)F)Cl
Complexity: 197
Covalently-bondedUnitCount: 1
HeavyAtomCount: 13
HydrogenBondAcceptorCount: 5
RotatableBondCount: 1
Xlogp3: 2.2
CatalogNumber:
AD40597
ChemicalName:
6-Chloro-5-(trifluoromethyl)nicotinaldehyde
CasNumber:
1113049-90-3
MolecularFormula:
C7H3ClF3NO
MolecularWeight:
209.553
MdlNumber:
MFCD18258310
Smiles:
O=Cc1cnc(c(c1)C(F)(F)F)Cl
Complexity:
197
Covalently-bondedUnitCount:
1
HeavyAtomCount:
13
HydrogenBondAcceptorCount:
5
RotatableBondCount:
1
Xlogp3:
2.2
CatalogNumber: __
ChemicalName: __
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MolecularFormula: __
MolecularWeight: __
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Smiles: COC(=O)c1cc(O)c(cc1N)F
Complexity: __
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
RotatableBondCount: __
Xlogp3: __
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CasNumber:
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MolecularFormula:
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Smiles:
COC(=O)c1cc(O)c(cc1N)F
Complexity:
__
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__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
RotatableBondCount:
__
Xlogp3:
__
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Smiles: COC(=O)/C(=C\c1ccccc1[N+](=O)[O-])/C(=O)C
Complexity: __
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MolecularFormula:
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Smiles:
COC(=O)/C(=C\c1ccccc1[N+](=O)[O-])/C(=O)C
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
RotatableBondCount:
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Xlogp3:
__
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Smiles: N[C@H]1CC=CC[C@H]1C(=O)N
Complexity: __
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
RotatableBondCount: __
Xlogp3: __
CatalogNumber:
__
ChemicalName:
__
CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
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Smiles:
N[C@H]1CC=CC[C@H]1C(=O)N
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
RotatableBondCount:
__
Xlogp3:
__