AE42909
135277-07-5 | 2-(Pyrrolidin-1-ylmethyl)benzonitrile
Manufacturer: A2B Chem
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CatalogNumber
AE42909
ChemicalName
2-(Pyrrolidin-1-ylmethyl)benzonitrile
CasNumber
135277-07-5
MolecularFormula
C12H14N2
MolecularWeight
186.253
MdlNumber
MFCD07339548
Smiles
N#Cc1ccccc1CN1CCCC1
Complexity
222
Covalently-bondedUnitCount
1
HeavyAtomCount
14
HydrogenBondAcceptorCount
2
RotatableBondCount
2
Xlogp3
2
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CatalogNumber: AE42909
ChemicalName: 2-(Pyrrolidin-1-ylmethyl)benzonitrile
CasNumber: 135277-07-5
MolecularFormula: C12H14N2
MolecularWeight: 186.253
MdlNumber: MFCD07339548
Smiles: N#Cc1ccccc1CN1CCCC1
Complexity: 222
Covalently-bondedUnitCount: 1
HeavyAtomCount: 14
HydrogenBondAcceptorCount: 2
RotatableBondCount: 2
Xlogp3: 2
CatalogNumber:
AE42909
ChemicalName:
2-(Pyrrolidin-1-ylmethyl)benzonitrile
CasNumber:
135277-07-5
MolecularFormula:
C12H14N2
MolecularWeight:
186.253
MdlNumber:
MFCD07339548
Smiles:
N#Cc1ccccc1CN1CCCC1
Complexity:
222
Covalently-bondedUnitCount:
1
HeavyAtomCount:
14
HydrogenBondAcceptorCount:
2
RotatableBondCount:
2
Xlogp3:
2
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Smiles: CNC1CCN(C1)C(=O)OCc1ccccc1
Complexity: __
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HydrogenBondAcceptorCount: __
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Smiles:
CNC1CCN(C1)C(=O)OCc1ccccc1
Complexity:
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RotatableBondCount:
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Smiles: Nc1ccc(cc1)Oc1ccc(cc1)Oc1ccc(cc1)Oc1ccc(cc1)N
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Smiles:
Nc1ccc(cc1)Oc1ccc(cc1)Oc1ccc(cc1)Oc1ccc(cc1)N
Complexity:
__
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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: N1CCC(CC1)CCc1ccccc1.Cl
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HeavyAtomCount: __
HydrogenBondAcceptorCount: __
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Xlogp3: __
CatalogNumber:
__
ChemicalName:
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CasNumber:
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MolecularFormula:
__
MolecularWeight:
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MdlNumber:
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Smiles:
N1CCC(CC1)CCc1ccccc1.Cl
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
RotatableBondCount:
__
Xlogp3:
__