AI41937
1864062-45-2 | 5-[2-(Dimethylamino)ethoxy]-2-fluorobenzonitrile
Manufacturer: A2B Chem
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CatalogNumber
AI41937
ChemicalName
5-[2-(Dimethylamino)ethoxy]-2-fluorobenzonitrile
CasNumber
1864062-45-2
MolecularFormula
C11H13FN2O
MolecularWeight
208.2321
MdlNumber
MFCD29035401
Smiles
N#Cc1cc(OCCN(C)C)ccc1F
Complexity
236
Covalently-bondedUnitCount
1
HeavyAtomCount
15
HydrogenBondAcceptorCount
4
RotatableBondCount
4
Xlogp3
1.7
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CatalogNumber: AI41937
ChemicalName: 5-[2-(Dimethylamino)ethoxy]-2-fluorobenzonitrile
CasNumber: 1864062-45-2
MolecularFormula: C11H13FN2O
MolecularWeight: 208.2321
MdlNumber: MFCD29035401
Smiles: N#Cc1cc(OCCN(C)C)ccc1F
Complexity: 236
Covalently-bondedUnitCount: 1
HeavyAtomCount: 15
HydrogenBondAcceptorCount: 4
RotatableBondCount: 4
Xlogp3: 1.7
CatalogNumber:
AI41937
ChemicalName:
5-[2-(Dimethylamino)ethoxy]-2-fluorobenzonitrile
CasNumber:
1864062-45-2
MolecularFormula:
C11H13FN2O
MolecularWeight:
208.2321
MdlNumber:
MFCD29035401
Smiles:
N#Cc1cc(OCCN(C)C)ccc1F
Complexity:
236
Covalently-bondedUnitCount:
1
HeavyAtomCount:
15
HydrogenBondAcceptorCount:
4
RotatableBondCount:
4
Xlogp3:
1.7
CatalogNumber: AI41938
ChemicalName: 1-Bromo-4-methanesulfonyl-2,5-dimethylbenzene
CasNumber: 1864063-77-3
MolecularFormula: C9H11BrO2S
MolecularWeight: 263.1514
MdlNumber: MFCD29035425
Smiles: Cc1cc(c(cc1Br)C)S(=O)(=O)C
Complexity: 268
Covalently-bondedUnitCount: 1
HeavyAtomCount: 13
HydrogenBondAcceptorCount: 2
RotatableBondCount: 1
Xlogp3: 2.6
CatalogNumber:
AI41938
ChemicalName:
1-Bromo-4-methanesulfonyl-2,5-dimethylbenzene
CasNumber:
1864063-77-3
MolecularFormula:
C9H11BrO2S
MolecularWeight:
263.1514
MdlNumber:
MFCD29035425
Smiles:
Cc1cc(c(cc1Br)C)S(=O)(=O)C
Complexity:
268
Covalently-bondedUnitCount:
1
HeavyAtomCount:
13
HydrogenBondAcceptorCount:
2
RotatableBondCount:
1
Xlogp3:
2.6
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Smiles: COC(=O)CC(c1cccc(c1)O)C1CCCC1
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COC(=O)CC(c1cccc(c1)O)C1CCCC1
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Smiles: Brc1cc2[nH]cc(c2cc1Cl)C
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Brc1cc2[nH]cc(c2cc1Cl)C
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HydrogenBondAcceptorCount:
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