AB25678
247089-76-5 | (3-Bromophenyl)(4-fluorophenyl)methanol
Manufacturer: A2B Chem
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CatalogNumber
AB25678
ChemicalName
(3-Bromophenyl)(4-fluorophenyl)methanol
CasNumber
247089-76-5
MolecularFormula
C13H10BrFO
MolecularWeight
281.1203
MdlNumber
MFCD12153608
Smiles
Fc1ccc(cc1)C(c1cccc(c1)Br)O
Complexity
216
Covalently-bondedUnitCount
1
HeavyAtomCount
16
HydrogenBondAcceptorCount
2
HydrogenBondDonorCount
1
RotatableBondCount
2
UndefinedAtomStereocenterCount
1
Xlogp3
3.5
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CatalogNumber: AB25678
ChemicalName: (3-Bromophenyl)(4-fluorophenyl)methanol
CasNumber: 247089-76-5
MolecularFormula: C13H10BrFO
MolecularWeight: 281.1203
MdlNumber: MFCD12153608
Smiles: Fc1ccc(cc1)C(c1cccc(c1)Br)O
Complexity: 216
Covalently-bondedUnitCount: 1
HeavyAtomCount: 16
HydrogenBondAcceptorCount: 2
HydrogenBondDonorCount: 1
RotatableBondCount: 2
UndefinedAtomStereocenterCount: 1
Xlogp3: 3.5
CatalogNumber:
AB25678
ChemicalName:
(3-Bromophenyl)(4-fluorophenyl)methanol
CasNumber:
247089-76-5
MolecularFormula:
C13H10BrFO
MolecularWeight:
281.1203
MdlNumber:
MFCD12153608
Smiles:
Fc1ccc(cc1)C(c1cccc(c1)Br)O
Complexity:
216
Covalently-bondedUnitCount:
1
HeavyAtomCount:
16
HydrogenBondAcceptorCount:
2
HydrogenBondDonorCount:
1
RotatableBondCount:
2
UndefinedAtomStereocenterCount:
1
Xlogp3:
3.5
CatalogNumber: __
ChemicalName: __
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MolecularFormula: __
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Smiles: O=Cc1cccc(c1)OCc1ccc(cc1)[N+](=O)[O-]
Complexity: __
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
HydrogenBondDonorCount: __
RotatableBondCount: __
UndefinedAtomStereocenterCount: __
Xlogp3: __
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Smiles:
O=Cc1cccc(c1)OCc1ccc(cc1)[N+](=O)[O-]
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
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HydrogenBondDonorCount:
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RotatableBondCount:
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UndefinedAtomStereocenterCount:
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Xlogp3:
__
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Smiles: OC(=O)c1ccccc1C(=O)n1ccnc1C
Complexity: __
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HeavyAtomCount: __
HydrogenBondAcceptorCount: __
HydrogenBondDonorCount: __
RotatableBondCount: __
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MolecularFormula:
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Smiles:
OC(=O)c1ccccc1C(=O)n1ccnc1C
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
HydrogenBondDonorCount:
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RotatableBondCount:
__
UndefinedAtomStereocenterCount:
__
Xlogp3:
__
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MolecularFormula: __
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Smiles: CCOc1ccc(cc1)C[C@@H](C(=O)O)NC(=O)OC(C)(C)C
Complexity: __
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
HydrogenBondDonorCount: __
RotatableBondCount: __
UndefinedAtomStereocenterCount: __
Xlogp3: __
CatalogNumber:
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CasNumber:
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MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
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Smiles:
CCOc1ccc(cc1)C[C@@H](C(=O)O)NC(=O)OC(C)(C)C
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
HydrogenBondDonorCount:
__
RotatableBondCount:
__
UndefinedAtomStereocenterCount:
__
Xlogp3:
__