AI43297
19179-31-8 | 3,5-Dimethoxybenzonitrile
Manufacturer: A2B Chem
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CatalogNumber
AI43297
ChemicalName
3,5-Dimethoxybenzonitrile
CasNumber
19179-31-8
MolecularFormula
C9H9NO2
MolecularWeight
163.1733
MdlNumber
MFCD00001804
Smiles
COc1cc(OC)cc(c1)C#N
NscNumber
73710
Complexity
172
Covalently-bondedUnitCount
1
HeavyAtomCount
12
HydrogenBondAcceptorCount
3
RotatableBondCount
2
Xlogp3
1.6
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CatalogNumber: AI43297
ChemicalName: 3,5-Dimethoxybenzonitrile
CasNumber: 19179-31-8
MolecularFormula: C9H9NO2
MolecularWeight: 163.1733
MdlNumber: MFCD00001804
Smiles: COc1cc(OC)cc(c1)C#N
NscNumber: 73710
Complexity: 172
Covalently-bondedUnitCount: 1
HeavyAtomCount: 12
HydrogenBondAcceptorCount: 3
RotatableBondCount: 2
Xlogp3: 1.6
CatalogNumber:
AI43297
ChemicalName:
3,5-Dimethoxybenzonitrile
CasNumber:
19179-31-8
MolecularFormula:
C9H9NO2
MolecularWeight:
163.1733
MdlNumber:
MFCD00001804
Smiles:
COc1cc(OC)cc(c1)C#N
NscNumber:
73710
Complexity:
172
Covalently-bondedUnitCount:
1
HeavyAtomCount:
12
HydrogenBondAcceptorCount:
3
RotatableBondCount:
2
Xlogp3:
1.6
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Smiles: OC(=O)Cn1nc(c2c1cccc2)C
NscNumber: __
Complexity: __
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
RotatableBondCount: __
Xlogp3: __
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__
ChemicalName:
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CasNumber:
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MolecularFormula:
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MolecularWeight:
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MdlNumber:
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Smiles:
OC(=O)Cn1nc(c2c1cccc2)C
NscNumber:
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Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
RotatableBondCount:
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Xlogp3:
__
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Smiles: COC(=O)C(c1ccccc1)(N)C.Cl
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HydrogenBondAcceptorCount: __
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Xlogp3: __
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CasNumber:
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MolecularFormula:
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MolecularWeight:
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MdlNumber:
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Smiles:
COC(=O)C(c1ccccc1)(N)C.Cl
NscNumber:
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Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
RotatableBondCount:
__
Xlogp3:
__
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MolecularFormula: __
MolecularWeight: __
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Smiles: Oc1ccc2c(c1)c(=O)n(cn2)C
NscNumber: __
Complexity: __
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
RotatableBondCount: __
Xlogp3: __
CatalogNumber:
__
ChemicalName:
__
CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
__
Smiles:
Oc1ccc2c(c1)c(=O)n(cn2)C
NscNumber:
__
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
RotatableBondCount:
__
Xlogp3:
__