AD60640
204078-26-2 | 4-(Isopropylamino)benzonitrile
Manufacturer: A2B Chem
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CatalogNumber
AD60640
ChemicalName
4-(Isopropylamino)benzonitrile
CasNumber
204078-26-2
MolecularFormula
C10H12N2
MolecularWeight
160.21568
MdlNumber
MFCD11145772
Smiles
CC(Nc1ccc(cc1)C#N)C
Complexity
170
Covalently-bondedUnitCount
1
HeavyAtomCount
12
HydrogenBondAcceptorCount
2
HydrogenBondDonorCount
1
RotatableBondCount
2
Xlogp3
2.4
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CatalogNumber: AD60640
ChemicalName: 4-(Isopropylamino)benzonitrile
CasNumber: 204078-26-2
MolecularFormula: C10H12N2
MolecularWeight: 160.21568
MdlNumber: MFCD11145772
Smiles: CC(Nc1ccc(cc1)C#N)C
Complexity: 170
Covalently-bondedUnitCount: 1
HeavyAtomCount: 12
HydrogenBondAcceptorCount: 2
HydrogenBondDonorCount: 1
RotatableBondCount: 2
Xlogp3: 2.4
CatalogNumber:
AD60640
ChemicalName:
4-(Isopropylamino)benzonitrile
CasNumber:
204078-26-2
MolecularFormula:
C10H12N2
MolecularWeight:
160.21568
MdlNumber:
MFCD11145772
Smiles:
CC(Nc1ccc(cc1)C#N)C
Complexity:
170
Covalently-bondedUnitCount:
1
HeavyAtomCount:
12
HydrogenBondAcceptorCount:
2
HydrogenBondDonorCount:
1
RotatableBondCount:
2
Xlogp3:
2.4
CatalogNumber: __
ChemicalName: __
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Smiles: COc1ccc(nc1)C1(CCCCC1)CNC(=O)[C@](Cc1c[nH]c2c1cccc2)(NC(=O)Nc1ccc(cc1)[N+](=O)[O-])C
Complexity: __
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HydrogenBondAcceptorCount: __
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Smiles:
COc1ccc(nc1)C1(CCCCC1)CNC(=O)[C@](Cc1c[nH]c2c1cccc2)(NC(=O)Nc1ccc(cc1)[N+](=O)[O-])C
Complexity:
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Smiles: SCCCCCCCCC(=O)O
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Smiles:
SCCCCCCCCC(=O)O
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Smiles: Nc1n[nH]c(c1)OCCOc1ccccc1
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Smiles:
Nc1n[nH]c(c1)OCCOc1ccccc1
Complexity:
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Covalently-bondedUnitCount:
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HeavyAtomCount:
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HydrogenBondAcceptorCount:
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HydrogenBondDonorCount:
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RotatableBondCount:
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Xlogp3:
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