AI17398
1260837-23-7 | 3-Bromo-4-(pyrrolidin-1-yl)benzonitrile
Manufacturer: A2B Chem
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CatalogNumber
AI17398
ChemicalName
3-Bromo-4-(pyrrolidin-1-yl)benzonitrile
CasNumber
1260837-23-7
MolecularFormula
C11H11BrN2
MolecularWeight
251.1224
MdlNumber
MFCD11038369
Smiles
N#Cc1ccc(c(c1)Br)N1CCCC1
Complexity
239
Covalently-bondedUnitCount
1
HeavyAtomCount
14
HydrogenBondAcceptorCount
2
RotatableBondCount
1
Xlogp3
2.9
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CatalogNumber: AI17398
ChemicalName: 3-Bromo-4-(pyrrolidin-1-yl)benzonitrile
CasNumber: 1260837-23-7
MolecularFormula: C11H11BrN2
MolecularWeight: 251.1224
MdlNumber: MFCD11038369
Smiles: N#Cc1ccc(c(c1)Br)N1CCCC1
Complexity: 239
Covalently-bondedUnitCount: 1
HeavyAtomCount: 14
HydrogenBondAcceptorCount: 2
RotatableBondCount: 1
Xlogp3: 2.9
CatalogNumber:
AI17398
ChemicalName:
3-Bromo-4-(pyrrolidin-1-yl)benzonitrile
CasNumber:
1260837-23-7
MolecularFormula:
C11H11BrN2
MolecularWeight:
251.1224
MdlNumber:
MFCD11038369
Smiles:
N#Cc1ccc(c(c1)Br)N1CCCC1
Complexity:
239
Covalently-bondedUnitCount:
1
HeavyAtomCount:
14
HydrogenBondAcceptorCount:
2
RotatableBondCount:
1
Xlogp3:
2.9
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Smiles: Fc1ccc(c(c1)F)C1CNC1
Complexity: __
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HeavyAtomCount: __
HydrogenBondAcceptorCount: __
RotatableBondCount: __
Xlogp3: __
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__
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Smiles:
Fc1ccc(c(c1)F)C1CNC1
Complexity:
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__
HydrogenBondAcceptorCount:
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RotatableBondCount:
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Xlogp3:
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Smiles: Fc1cccc(c1C1CNC1)F
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__
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Smiles:
Fc1cccc(c1C1CNC1)F
Complexity:
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Covalently-bondedUnitCount:
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__
HydrogenBondAcceptorCount:
__
RotatableBondCount:
__
Xlogp3:
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Smiles: Brc1ncc2c(c1)c(N)ccc2
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Smiles:
Brc1ncc2c(c1)c(N)ccc2
Complexity:
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Covalently-bondedUnitCount:
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HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
RotatableBondCount:
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Xlogp3:
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