AH94187
90389-96-1 | 3-[(Methylamino)methyl]benzonitrile
Manufacturer: A2B Chem
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CatalogNumber
AH94187
ChemicalName
3-[(Methylamino)methyl]benzonitrile
CasNumber
90389-96-1
MolecularFormula
C9H10N2
MolecularWeight
146.1891
MdlNumber
MFCD09731650
Smiles
CNCc1cccc(c1)C#N
Complexity
156
Covalently-bondedUnitCount
1
HeavyAtomCount
11
HydrogenBondAcceptorCount
2
HydrogenBondDonorCount
1
RotatableBondCount
2
Xlogp3
1.1
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CatalogNumber: AH94187
ChemicalName: 3-[(Methylamino)methyl]benzonitrile
CasNumber: 90389-96-1
MolecularFormula: C9H10N2
MolecularWeight: 146.1891
MdlNumber: MFCD09731650
Smiles: CNCc1cccc(c1)C#N
Complexity: 156
Covalently-bondedUnitCount: 1
HeavyAtomCount: 11
HydrogenBondAcceptorCount: 2
HydrogenBondDonorCount: 1
RotatableBondCount: 2
Xlogp3: 1.1
CatalogNumber:
AH94187
ChemicalName:
3-[(Methylamino)methyl]benzonitrile
CasNumber:
90389-96-1
MolecularFormula:
C9H10N2
MolecularWeight:
146.1891
MdlNumber:
MFCD09731650
Smiles:
CNCc1cccc(c1)C#N
Complexity:
156
Covalently-bondedUnitCount:
1
HeavyAtomCount:
11
HydrogenBondAcceptorCount:
2
HydrogenBondDonorCount:
1
RotatableBondCount:
2
Xlogp3:
1.1
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Smiles: O=Cc1c[nH]c2c1c(Cl)ncn2
Complexity: __
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HeavyAtomCount: __
HydrogenBondAcceptorCount: __
HydrogenBondDonorCount: __
RotatableBondCount: __
Xlogp3: __
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__
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Smiles:
O=Cc1c[nH]c2c1c(Cl)ncn2
Complexity:
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HeavyAtomCount:
__
HydrogenBondAcceptorCount:
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RotatableBondCount:
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Smiles: Ic1cncnc1C
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Smiles:
Ic1cncnc1C
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HydrogenBondDonorCount:
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RotatableBondCount:
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Smiles: O=C(OC(C)(C)C)N[C@]1(C)CNCC1
Complexity: __
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
HydrogenBondDonorCount: __
RotatableBondCount: __
Xlogp3: __
CatalogNumber:
__
ChemicalName:
__
CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
__
Smiles:
O=C(OC(C)(C)C)N[C@]1(C)CNCC1
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
HydrogenBondDonorCount:
__
RotatableBondCount:
__
Xlogp3:
__