AE24445
1068604-45-4 | 3-Bromo-5-(4-methoxy-benzyloxy)-benzonitrile
Manufacturer: A2B Chem
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CatalogNumber
AE24445
ChemicalName
3-Bromo-5-(4-methoxy-benzyloxy)-benzonitrile
CasNumber
1068604-45-4
MolecularFormula
C15H12BrNO2
MolecularWeight
318.1653
MdlNumber
MFCD28968029
Smiles
COc1ccc(cc1)COc1cc(Br)cc(c1)C#N
Complexity
319
Covalently-bondedUnitCount
1
HeavyAtomCount
19
HydrogenBondAcceptorCount
3
RotatableBondCount
4
Xlogp3
3.8
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CatalogNumber: AE24445
ChemicalName: 3-Bromo-5-(4-methoxy-benzyloxy)-benzonitrile
CasNumber: 1068604-45-4
MolecularFormula: C15H12BrNO2
MolecularWeight: 318.1653
MdlNumber: MFCD28968029
Smiles: COc1ccc(cc1)COc1cc(Br)cc(c1)C#N
Complexity: 319
Covalently-bondedUnitCount: 1
HeavyAtomCount: 19
HydrogenBondAcceptorCount: 3
RotatableBondCount: 4
Xlogp3: 3.8
CatalogNumber:
AE24445
ChemicalName:
3-Bromo-5-(4-methoxy-benzyloxy)-benzonitrile
CasNumber:
1068604-45-4
MolecularFormula:
C15H12BrNO2
MolecularWeight:
318.1653
MdlNumber:
MFCD28968029
Smiles:
COc1ccc(cc1)COc1cc(Br)cc(c1)C#N
Complexity:
319
Covalently-bondedUnitCount:
1
HeavyAtomCount:
19
HydrogenBondAcceptorCount:
3
RotatableBondCount:
4
Xlogp3:
3.8
CatalogNumber: __
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MolecularFormula: __
MolecularWeight: __
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Smiles: OC(=O)c1cccn2c1ncc2Br
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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Smiles:
OC(=O)c1cccn2c1ncc2Br
Complexity:
__
Covalently-bondedUnitCount:
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HeavyAtomCount:
__
HydrogenBondAcceptorCount:
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RotatableBondCount:
__
Xlogp3:
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Smiles: Ic1cnc2n1ccc(c2)C(F)(F)F
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HydrogenBondAcceptorCount: __
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__
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CasNumber:
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MolecularFormula:
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Smiles:
Ic1cnc2n1ccc(c2)C(F)(F)F
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
RotatableBondCount:
__
Xlogp3:
__
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Smiles: N#Cc1cc([N+](=O)[O-])c(cc1Br)N
Complexity: __
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HeavyAtomCount: __
HydrogenBondAcceptorCount: __
RotatableBondCount: __
Xlogp3: __
CatalogNumber:
__
ChemicalName:
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CasNumber:
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MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
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Smiles:
N#Cc1cc([N+](=O)[O-])c(cc1Br)N
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
RotatableBondCount:
__
Xlogp3:
__