AA97739
182287-63-4 | 4-(Bromomethyl)-3-iodobenzonitrile
Manufacturer: A2B Chem
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CatalogNumber
AA97739
ChemicalName
4-(Bromomethyl)-3-iodobenzonitrile
CasNumber
182287-63-4
MolecularFormula
C8H5BrIN
MolecularWeight
321.9405
MdlNumber
MFCD16872046
Smiles
N#Cc1ccc(c(c1)I)CBr
Complexity
174
Covalently-bondedUnitCount
1
HeavyAtomCount
11
HydrogenBondAcceptorCount
1
RotatableBondCount
1
Xlogp3
2.8
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CatalogNumber: AA97739
ChemicalName: 4-(Bromomethyl)-3-iodobenzonitrile
CasNumber: 182287-63-4
MolecularFormula: C8H5BrIN
MolecularWeight: 321.9405
MdlNumber: MFCD16872046
Smiles: N#Cc1ccc(c(c1)I)CBr
Complexity: 174
Covalently-bondedUnitCount: 1
HeavyAtomCount: 11
HydrogenBondAcceptorCount: 1
RotatableBondCount: 1
Xlogp3: 2.8
CatalogNumber:
AA97739
ChemicalName:
4-(Bromomethyl)-3-iodobenzonitrile
CasNumber:
182287-63-4
MolecularFormula:
C8H5BrIN
MolecularWeight:
321.9405
MdlNumber:
MFCD16872046
Smiles:
N#Cc1ccc(c(c1)I)CBr
Complexity:
174
Covalently-bondedUnitCount:
1
HeavyAtomCount:
11
HydrogenBondAcceptorCount:
1
RotatableBondCount:
1
Xlogp3:
2.8
CatalogNumber: __
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MolecularFormula: __
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Smiles: CCOc1cc(C#N)ccc1C
Complexity: __
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HeavyAtomCount: __
HydrogenBondAcceptorCount: __
RotatableBondCount: __
Xlogp3: __
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MolecularFormula:
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Smiles:
CCOc1cc(C#N)ccc1C
Complexity:
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HydrogenBondAcceptorCount:
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RotatableBondCount:
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Xlogp3:
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Smiles: OC(=O)C(NC(=O)OC(C)(C)C)CC1CCOCC1
Complexity: __
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HydrogenBondAcceptorCount: __
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__
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CasNumber:
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MolecularFormula:
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MolecularWeight:
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Smiles:
OC(=O)C(NC(=O)OC(C)(C)C)CC1CCOCC1
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
RotatableBondCount:
__
Xlogp3:
__
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MolecularFormula: __
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Smiles: NC(C(=O)O)CC1CCOCC1.Cl
Complexity: __
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
RotatableBondCount: __
Xlogp3: __
CatalogNumber:
__
ChemicalName:
__
CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
__
Smiles:
NC(C(=O)O)CC1CCOCC1.Cl
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
RotatableBondCount:
__
Xlogp3:
__