AH76267
77532-87-7 | 2-Bromo-6-formylbenzonitrile
Manufacturer: A2B Chem
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CatalogNumber
AH76267
ChemicalName
2-Bromo-6-formylbenzonitrile
CasNumber
77532-87-7
MolecularFormula
C8H4BrNO
MolecularWeight
210.0275
MdlNumber
MFCD18390711
Smiles
O=Cc1cccc(c1C#N)Br
Complexity
196
Covalently-bondedUnitCount
1
HeavyAtomCount
11
HydrogenBondAcceptorCount
2
RotatableBondCount
1
Xlogp3
1.8
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CatalogNumber: AH76267
ChemicalName: 2-Bromo-6-formylbenzonitrile
CasNumber: 77532-87-7
MolecularFormula: C8H4BrNO
MolecularWeight: 210.0275
MdlNumber: MFCD18390711
Smiles: O=Cc1cccc(c1C#N)Br
Complexity: 196
Covalently-bondedUnitCount: 1
HeavyAtomCount: 11
HydrogenBondAcceptorCount: 2
RotatableBondCount: 1
Xlogp3: 1.8
CatalogNumber:
AH76267
ChemicalName:
2-Bromo-6-formylbenzonitrile
CasNumber:
77532-87-7
MolecularFormula:
C8H4BrNO
MolecularWeight:
210.0275
MdlNumber:
MFCD18390711
Smiles:
O=Cc1cccc(c1C#N)Br
Complexity:
196
Covalently-bondedUnitCount:
1
HeavyAtomCount:
11
HydrogenBondAcceptorCount:
2
RotatableBondCount:
1
Xlogp3:
1.8
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Smiles: N#CC1CCc2c1cc(Br)cc2
Complexity: __
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HeavyAtomCount: __
HydrogenBondAcceptorCount: __
RotatableBondCount: __
Xlogp3: __
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MolecularFormula:
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Smiles:
N#CC1CCc2c1cc(Br)cc2
Complexity:
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Covalently-bondedUnitCount:
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HeavyAtomCount:
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HydrogenBondAcceptorCount:
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RotatableBondCount:
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Xlogp3:
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Smiles: CC1=C(C(=CC(=C1)C#N)[N+](=O)[O-])Br
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Smiles:
CC1=C(C(=CC(=C1)C#N)[N+](=O)[O-])Br
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
RotatableBondCount:
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Xlogp3:
__
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Smiles: COc1ccc(cc1)c1c(Br)c(=O)n(c2c1cccc2)C
Complexity: __
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
RotatableBondCount: __
Xlogp3: __
CatalogNumber:
__
ChemicalName:
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CasNumber:
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MolecularFormula:
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MolecularWeight:
__
MdlNumber:
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Smiles:
COc1ccc(cc1)c1c(Br)c(=O)n(c2c1cccc2)C
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
RotatableBondCount:
__
Xlogp3:
__