AI54998
688363-79-3 | 2-(Benzyloxy)-1-bromo-3-nitrobenzene
Manufacturer: A2B Chem
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CatalogNumber
AI54998
ChemicalName
2-(Benzyloxy)-1-bromo-3-nitrobenzene
CasNumber
688363-79-3
MolecularFormula
C13H10BrNO3
MolecularWeight
308.1274
MdlNumber
MFCD12198243
Smiles
Brc1cccc(c1OCc1ccccc1)[N+](=O)[O-]
Complexity
276
Covalently-bondedUnitCount
1
HeavyAtomCount
18
HydrogenBondAcceptorCount
3
RotatableBondCount
3
Xlogp3
3.9
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CatalogNumber: AI54998
ChemicalName: 2-(Benzyloxy)-1-bromo-3-nitrobenzene
CasNumber: 688363-79-3
MolecularFormula: C13H10BrNO3
MolecularWeight: 308.1274
MdlNumber: MFCD12198243
Smiles: Brc1cccc(c1OCc1ccccc1)[N+](=O)[O-]
Complexity: 276
Covalently-bondedUnitCount: 1
HeavyAtomCount: 18
HydrogenBondAcceptorCount: 3
RotatableBondCount: 3
Xlogp3: 3.9
CatalogNumber:
AI54998
ChemicalName:
2-(Benzyloxy)-1-bromo-3-nitrobenzene
CasNumber:
688363-79-3
MolecularFormula:
C13H10BrNO3
MolecularWeight:
308.1274
MdlNumber:
MFCD12198243
Smiles:
Brc1cccc(c1OCc1ccccc1)[N+](=O)[O-]
Complexity:
276
Covalently-bondedUnitCount:
1
HeavyAtomCount:
18
HydrogenBondAcceptorCount:
3
RotatableBondCount:
3
Xlogp3:
3.9
CatalogNumber: AI54999
ChemicalName: 1,2-Bis(1-hydroxyethyl)benzene
CasNumber: 68850-07-7
MolecularFormula: C10H14O2
MolecularWeight: 166.217
MdlNumber: MFCD29043352
Smiles: CC(c1ccccc1C(O)C)O
Complexity: 120
Covalently-bondedUnitCount: 1
HeavyAtomCount: 12
HydrogenBondAcceptorCount: 2
RotatableBondCount: 2
Xlogp3: 1
CatalogNumber:
AI54999
ChemicalName:
1,2-Bis(1-hydroxyethyl)benzene
CasNumber:
68850-07-7
MolecularFormula:
C10H14O2
MolecularWeight:
166.217
MdlNumber:
MFCD29043352
Smiles:
CC(c1ccccc1C(O)C)O
Complexity:
120
Covalently-bondedUnitCount:
1
HeavyAtomCount:
12
HydrogenBondAcceptorCount:
2
RotatableBondCount:
2
Xlogp3:
1
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Smiles: C1CC1C2=NC3=CC=CC=C3C(=C2C=CC(CC(CC(=O)O)O)O)C4=CC=C(C=C4)F
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Smiles:
C1CC1C2=NC3=CC=CC=C3C(=C2C=CC(CC(CC(=O)O)O)O)C4=CC=C(C=C4)F
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HydrogenBondAcceptorCount:
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RotatableBondCount:
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Xlogp3:
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