AE16746
1187983-97-6 | 4-Bromo-2-(trifluoromethoxy)benzonitrile
Manufacturer: A2B Chem
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CatalogNumber
AE16746
ChemicalName
4-Bromo-2-(trifluoromethoxy)benzonitrile
CasNumber
1187983-97-6
MolecularFormula
C8H3BrF3NO
MolecularWeight
266.0147
MdlNumber
MFCD12761591
Smiles
N#Cc1ccc(cc1OC(F)(F)F)Br
Complexity
247
Covalently-bondedUnitCount
1
HeavyAtomCount
14
HydrogenBondAcceptorCount
5
RotatableBondCount
1
Xlogp3
3.5
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CatalogNumber: AE16746
ChemicalName: 4-Bromo-2-(trifluoromethoxy)benzonitrile
CasNumber: 1187983-97-6
MolecularFormula: C8H3BrF3NO
MolecularWeight: 266.0147
MdlNumber: MFCD12761591
Smiles: N#Cc1ccc(cc1OC(F)(F)F)Br
Complexity: 247
Covalently-bondedUnitCount: 1
HeavyAtomCount: 14
HydrogenBondAcceptorCount: 5
RotatableBondCount: 1
Xlogp3: 3.5
CatalogNumber:
AE16746
ChemicalName:
4-Bromo-2-(trifluoromethoxy)benzonitrile
CasNumber:
1187983-97-6
MolecularFormula:
C8H3BrF3NO
MolecularWeight:
266.0147
MdlNumber:
MFCD12761591
Smiles:
N#Cc1ccc(cc1OC(F)(F)F)Br
Complexity:
247
Covalently-bondedUnitCount:
1
HeavyAtomCount:
14
HydrogenBondAcceptorCount:
5
RotatableBondCount:
1
Xlogp3:
3.5
CatalogNumber: AE16747
ChemicalName: 2-Bromo-1h-indole-3-carbaldehyde
CasNumber: 119910-45-1
MolecularFormula: C9H6BrNO
MolecularWeight: 224.05403999999996
MdlNumber: MFCD18449874
Smiles: O=Cc1c(Br)[nH]c2c1cccc2
Complexity: 185
Covalently-bondedUnitCount: 1
HeavyAtomCount: 12
HydrogenBondAcceptorCount: 1
RotatableBondCount: 1
Xlogp3: 2.5
CatalogNumber:
AE16747
ChemicalName:
2-Bromo-1h-indole-3-carbaldehyde
CasNumber:
119910-45-1
MolecularFormula:
C9H6BrNO
MolecularWeight:
224.05403999999996
MdlNumber:
MFCD18449874
Smiles:
O=Cc1c(Br)[nH]c2c1cccc2
Complexity:
185
Covalently-bondedUnitCount:
1
HeavyAtomCount:
12
HydrogenBondAcceptorCount:
1
RotatableBondCount:
1
Xlogp3:
2.5
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Smiles: Fc1cccc(c1)[C@@H](C(F)(F)F)N
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Smiles:
Fc1cccc(c1)[C@@H](C(F)(F)F)N
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Smiles: C1CCC(CN1)Oc1ncccn1.Cl
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MolecularFormula:
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Smiles:
C1CCC(CN1)Oc1ncccn1.Cl
Complexity:
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Covalently-bondedUnitCount:
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HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
RotatableBondCount:
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Xlogp3:
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