AF38532
29786-45-6 | 1-(4-Methoxyphenyl)cyclobutanecarbonitrile
Manufacturer: A2B Chem
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CatalogNumber
AF38532
ChemicalName
1-(4-Methoxyphenyl)cyclobutanecarbonitrile
CasNumber
29786-45-6
MolecularFormula
C12H13NO
MolecularWeight
187.2377
MdlNumber
MFCD00297175
Smiles
COc1ccc(cc1)C1(CCC1)C#N
Complexity
240
Covalently-bondedUnitCount
1
HeavyAtomCount
14
HydrogenBondAcceptorCount
2
RotatableBondCount
2
Xlogp3
2.4
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CatalogNumber: AF38532
ChemicalName: 1-(4-Methoxyphenyl)cyclobutanecarbonitrile
CasNumber: 29786-45-6
MolecularFormula: C12H13NO
MolecularWeight: 187.2377
MdlNumber: MFCD00297175
Smiles: COc1ccc(cc1)C1(CCC1)C#N
Complexity: 240
Covalently-bondedUnitCount: 1
HeavyAtomCount: 14
HydrogenBondAcceptorCount: 2
RotatableBondCount: 2
Xlogp3: 2.4
CatalogNumber:
AF38532
ChemicalName:
1-(4-Methoxyphenyl)cyclobutanecarbonitrile
CasNumber:
29786-45-6
MolecularFormula:
C12H13NO
MolecularWeight:
187.2377
MdlNumber:
MFCD00297175
Smiles:
COc1ccc(cc1)C1(CCC1)C#N
Complexity:
240
Covalently-bondedUnitCount:
1
HeavyAtomCount:
14
HydrogenBondAcceptorCount:
2
RotatableBondCount:
2
Xlogp3:
2.4
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Smiles: C1=CC(=CC=C1C2=CC(=O)C3=C(O2)C=CC(=C3)F)Br
Complexity: __
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
RotatableBondCount: __
Xlogp3: __
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Smiles:
C1=CC(=CC=C1C2=CC(=O)C3=C(O2)C=CC(=C3)F)Br
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
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HydrogenBondAcceptorCount:
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RotatableBondCount:
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__
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Smiles: COc1ccccc1OCCN1C(=O)c2c(C1=O)cccc2
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Smiles:
COc1ccccc1OCCN1C(=O)c2c(C1=O)cccc2
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
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RotatableBondCount:
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Xlogp3:
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Smiles: ClCC(=O)c1cccc(c1)C
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HeavyAtomCount: __
HydrogenBondAcceptorCount: __
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Xlogp3: __
CatalogNumber:
__
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:
ClCC(=O)c1cccc(c1)C
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
RotatableBondCount:
__
Xlogp3:
__