AH83782
90004-90-3 | 2-(2-Bromophenoxy)acetonitrile
Manufacturer: A2B Chem
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CatalogNumber
AH83782
ChemicalName
2-(2-Bromophenoxy)acetonitrile
CasNumber
90004-90-3
MolecularFormula
C8H6BrNO
MolecularWeight
212.0433
MdlNumber
MFCD00798567
Smiles
N#CCOc1ccccc1Br
Complexity
163
Covalently-bondedUnitCount
1
HeavyAtomCount
11
HydrogenBondAcceptorCount
2
RotatableBondCount
2
Xlogp3
2.2
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CatalogNumber: AH83782
ChemicalName: 2-(2-Bromophenoxy)acetonitrile
CasNumber: 90004-90-3
MolecularFormula: C8H6BrNO
MolecularWeight: 212.0433
MdlNumber: MFCD00798567
Smiles: N#CCOc1ccccc1Br
Complexity: 163
Covalently-bondedUnitCount: 1
HeavyAtomCount: 11
HydrogenBondAcceptorCount: 2
RotatableBondCount: 2
Xlogp3: 2.2
CatalogNumber:
AH83782
ChemicalName:
2-(2-Bromophenoxy)acetonitrile
CasNumber:
90004-90-3
MolecularFormula:
C8H6BrNO
MolecularWeight:
212.0433
MdlNumber:
MFCD00798567
Smiles:
N#CCOc1ccccc1Br
Complexity:
163
Covalently-bondedUnitCount:
1
HeavyAtomCount:
11
HydrogenBondAcceptorCount:
2
RotatableBondCount:
2
Xlogp3:
2.2
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Smiles: CC1CNC(=N1)C
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HydrogenBondAcceptorCount: __
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Smiles:
CC1CNC(=N1)C
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RotatableBondCount:
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Smiles: SCC(=O)Nc1ccc2c(c1)cccc2
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Smiles:
SCC(=O)Nc1ccc2c(c1)cccc2
Complexity:
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HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
RotatableBondCount:
__
Xlogp3:
__
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Smiles: O=C(C[C@@H]1CC[C@@]2(CC1)OO[C@@]1(O2)[C@@H]2C[C@@H]3C[C@H]1C[C@H](C2)C3)NCC(N)(C)C
Complexity: __
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HeavyAtomCount: __
HydrogenBondAcceptorCount: __
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MolecularFormula:
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MolecularWeight:
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MdlNumber:
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Smiles:
O=C(C[C@@H]1CC[C@@]2(CC1)OO[C@@]1(O2)[C@@H]2C[C@@H]3C[C@H]1C[C@H](C2)C3)NCC(N)(C)C
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
RotatableBondCount:
__
Xlogp3:
__