AB70752
874-90-8 | 4-Methoxybenzonitrile
Manufacturer: A2B Chem
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CatalogNumber
AB70752
ChemicalName
4-Methoxybenzonitrile
CasNumber
874-90-8
MolecularFormula
C8H7NO
MolecularWeight
133.14728000000002
MdlNumber
MFCD00001818
Smiles
COc1ccc(cc1)C#N
Complexity
139
Covalently-bondedUnitCount
1
HeavyAtomCount
10
HydrogenBondAcceptorCount
2
RotatableBondCount
1
Xlogp3
1.9
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CatalogNumber: AB70752
ChemicalName: 4-Methoxybenzonitrile
CasNumber: 874-90-8
MolecularFormula: C8H7NO
MolecularWeight: 133.14728000000002
MdlNumber: MFCD00001818
Smiles: COc1ccc(cc1)C#N
Complexity: 139
Covalently-bondedUnitCount: 1
HeavyAtomCount: 10
HydrogenBondAcceptorCount: 2
RotatableBondCount: 1
Xlogp3: 1.9
CatalogNumber:
AB70752
ChemicalName:
4-Methoxybenzonitrile
CasNumber:
874-90-8
MolecularFormula:
C8H7NO
MolecularWeight:
133.14728000000002
MdlNumber:
MFCD00001818
Smiles:
COc1ccc(cc1)C#N
Complexity:
139
Covalently-bondedUnitCount:
1
HeavyAtomCount:
10
HydrogenBondAcceptorCount:
2
RotatableBondCount:
1
Xlogp3:
1.9
CatalogNumber: __
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CasNumber: __
MolecularFormula: __
MolecularWeight: __
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Smiles: CCCC(C(=O)OC1CC2CCC(C1)[N+]2(C)C)CCC.[Br-]
Complexity: __
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
RotatableBondCount: __
Xlogp3: __
CatalogNumber:
__
ChemicalName:
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CasNumber:
__
MolecularFormula:
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MolecularWeight:
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MdlNumber:
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Smiles:
CCCC(C(=O)OC1CC2CCC(C1)[N+]2(C)C)CCC.[Br-]
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
RotatableBondCount:
__
Xlogp3:
__
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: CCC(=O)OCc1ccc(cc1)OC
Complexity: __
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
RotatableBondCount: __
Xlogp3: __
CatalogNumber:
__
ChemicalName:
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CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
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Smiles:
CCC(=O)OCc1ccc(cc1)OC
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
RotatableBondCount:
__
Xlogp3:
__
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: O=C1c2ccccc2C(=O)c2c1c(O)c(c(c2)O)O
Complexity: __
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
RotatableBondCount: __
Xlogp3: __
CatalogNumber:
__
ChemicalName:
__
CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
__
Smiles:
O=C1c2ccccc2C(=O)c2c1c(O)c(c(c2)O)O
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
RotatableBondCount:
__
Xlogp3:
__