AD62088
1129540-65-3 | 2-Bromo-6-morpholinobenzonitrile
Manufacturer: A2B Chem
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CatalogNumber
AD62088
ChemicalName
2-Bromo-6-morpholinobenzonitrile
CasNumber
1129540-65-3
MolecularFormula
C11H11BrN2O
MolecularWeight
267.1218
MdlNumber
MFCD11037772
Smiles
N#Cc1c(Br)cccc1N1CCOCC1
Complexity
257
Covalently-bondedUnitCount
1
HeavyAtomCount
15
HydrogenBondAcceptorCount
3
RotatableBondCount
1
Xlogp3
2.1
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CatalogNumber: AD62088
ChemicalName: 2-Bromo-6-morpholinobenzonitrile
CasNumber: 1129540-65-3
MolecularFormula: C11H11BrN2O
MolecularWeight: 267.1218
MdlNumber: MFCD11037772
Smiles: N#Cc1c(Br)cccc1N1CCOCC1
Complexity: 257
Covalently-bondedUnitCount: 1
HeavyAtomCount: 15
HydrogenBondAcceptorCount: 3
RotatableBondCount: 1
Xlogp3: 2.1
CatalogNumber:
AD62088
ChemicalName:
2-Bromo-6-morpholinobenzonitrile
CasNumber:
1129540-65-3
MolecularFormula:
C11H11BrN2O
MolecularWeight:
267.1218
MdlNumber:
MFCD11037772
Smiles:
N#Cc1c(Br)cccc1N1CCOCC1
Complexity:
257
Covalently-bondedUnitCount:
1
HeavyAtomCount:
15
HydrogenBondAcceptorCount:
3
RotatableBondCount:
1
Xlogp3:
2.1
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Smiles: CC(=O)OC1CC[C@]2(C(=CC[C@@H]3[C@@H]2CC[C@]2([C@H]3CC[C@@H]2C(OC(=O)C)C)C)C1)C
Complexity: __
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HydrogenBondAcceptorCount: __
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Smiles:
CC(=O)OC1CC[C@]2(C(=CC[C@@H]3[C@@H]2CC[C@]2([C@H]3CC[C@@H]2C(OC(=O)C)C)C)C1)C
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Smiles: Ic1cnn(c1)C(c1ccccc1)(c1ccccc1)c1ccccc1
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Smiles:
Ic1cnn(c1)C(c1ccccc1)(c1ccccc1)c1ccccc1
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Smiles: c1ccc(cn1)NC1=NCCS1
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MolecularFormula:
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Smiles:
c1ccc(cn1)NC1=NCCS1
Complexity:
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Covalently-bondedUnitCount:
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HeavyAtomCount:
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HydrogenBondAcceptorCount:
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RotatableBondCount:
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Xlogp3:
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