AI05334
1017035-26-5 | 3-(Morpholine-4-carbonyl)benzonitrile
Manufacturer: A2B Chem
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CatalogNumber
AI05334
ChemicalName
3-(Morpholine-4-carbonyl)benzonitrile
CasNumber
1017035-26-5
MolecularFormula
C12H12N2O2
MolecularWeight
216.2359
MdlNumber
MFCD09942561
Smiles
N#Cc1cccc(c1)C(=O)N1CCOCC1
Complexity
301
Covalently-bondedUnitCount
1
HeavyAtomCount
16
HydrogenBondAcceptorCount
3
RotatableBondCount
1
Xlogp3
0.7
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CatalogNumber: AI05334
ChemicalName: 3-(Morpholine-4-carbonyl)benzonitrile
CasNumber: 1017035-26-5
MolecularFormula: C12H12N2O2
MolecularWeight: 216.2359
MdlNumber: MFCD09942561
Smiles: N#Cc1cccc(c1)C(=O)N1CCOCC1
Complexity: 301
Covalently-bondedUnitCount: 1
HeavyAtomCount: 16
HydrogenBondAcceptorCount: 3
RotatableBondCount: 1
Xlogp3: 0.7
CatalogNumber:
AI05334
ChemicalName:
3-(Morpholine-4-carbonyl)benzonitrile
CasNumber:
1017035-26-5
MolecularFormula:
C12H12N2O2
MolecularWeight:
216.2359
MdlNumber:
MFCD09942561
Smiles:
N#Cc1cccc(c1)C(=O)N1CCOCC1
Complexity:
301
Covalently-bondedUnitCount:
1
HeavyAtomCount:
16
HydrogenBondAcceptorCount:
3
RotatableBondCount:
1
Xlogp3:
0.7
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Smiles: Fc1cccc(c1)Oc1ncnc(c1)Cl
Complexity: __
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HeavyAtomCount: __
HydrogenBondAcceptorCount: __
RotatableBondCount: __
Xlogp3: __
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Smiles:
Fc1cccc(c1)Oc1ncnc(c1)Cl
Complexity:
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HydrogenBondAcceptorCount:
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RotatableBondCount:
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Smiles: COc1cccc(c1)Oc1ncnc(c1)Cl
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Smiles:
COc1cccc(c1)Oc1ncnc(c1)Cl
Complexity:
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HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
RotatableBondCount:
__
Xlogp3:
__
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Smiles: Clc1cccc(c1)C=C(c1cccs1)C(=O)O
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HeavyAtomCount: __
HydrogenBondAcceptorCount: __
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Xlogp3: __
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__
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__
MolecularFormula:
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MolecularWeight:
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Smiles:
Clc1cccc(c1)C=C(c1cccs1)C(=O)O
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
RotatableBondCount:
__
Xlogp3:
__