AC75756
944645-38-9 | (4-Bromophenyl)(3-fluorophenyl)methanol
Manufacturer: A2B Chem
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CatalogNumber
AC75756
ChemicalName
(4-Bromophenyl)(3-fluorophenyl)methanol
CasNumber
944645-38-9
MolecularFormula
C13H10BrFO
MolecularWeight
281.1203
MdlNumber
MFCD11096326
Smiles
Brc1ccc(cc1)C(c1cccc(c1)F)O
Complexity
216
Covalently-bondedUnitCount
1
HeavyAtomCount
16
HydrogenBondAcceptorCount
2
HydrogenBondDonorCount
1
RotatableBondCount
2
UndefinedAtomStereocenterCount
1
Xlogp3
3.5
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CatalogNumber: AC75756
ChemicalName: (4-Bromophenyl)(3-fluorophenyl)methanol
CasNumber: 944645-38-9
MolecularFormula: C13H10BrFO
MolecularWeight: 281.1203
MdlNumber: MFCD11096326
Smiles: Brc1ccc(cc1)C(c1cccc(c1)F)O
Complexity: 216
Covalently-bondedUnitCount: 1
HeavyAtomCount: 16
HydrogenBondAcceptorCount: 2
HydrogenBondDonorCount: 1
RotatableBondCount: 2
UndefinedAtomStereocenterCount: 1
Xlogp3: 3.5
CatalogNumber:
AC75756
ChemicalName:
(4-Bromophenyl)(3-fluorophenyl)methanol
CasNumber:
944645-38-9
MolecularFormula:
C13H10BrFO
MolecularWeight:
281.1203
MdlNumber:
MFCD11096326
Smiles:
Brc1ccc(cc1)C(c1cccc(c1)F)O
Complexity:
216
Covalently-bondedUnitCount:
1
HeavyAtomCount:
16
HydrogenBondAcceptorCount:
2
HydrogenBondDonorCount:
1
RotatableBondCount:
2
UndefinedAtomStereocenterCount:
1
Xlogp3:
3.5
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MolecularFormula: __
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Smiles: COc1cccc(c1OC(Cl)(Cl)Cl)Cl
Complexity: __
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
HydrogenBondDonorCount: __
RotatableBondCount: __
UndefinedAtomStereocenterCount: __
Xlogp3: __
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Smiles:
COc1cccc(c1OC(Cl)(Cl)Cl)Cl
Complexity:
__
Covalently-bondedUnitCount:
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HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
HydrogenBondDonorCount:
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RotatableBondCount:
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UndefinedAtomStereocenterCount:
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Xlogp3:
__
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Smiles: O=C(c1[nH]c(c(c1C)C(=O)OC(C)(C)C)C)OC(C)(C)C
Complexity: __
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
HydrogenBondDonorCount: __
RotatableBondCount: __
UndefinedAtomStereocenterCount: __
Xlogp3: __
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__
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CasNumber:
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MolecularFormula:
__
MolecularWeight:
__
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Smiles:
O=C(c1[nH]c(c(c1C)C(=O)OC(C)(C)C)C)OC(C)(C)C
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
HydrogenBondDonorCount:
__
RotatableBondCount:
__
UndefinedAtomStereocenterCount:
__
Xlogp3:
__
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ChemicalName: __
CasNumber: __
MolecularFormula: __
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Smiles: O=C(N1CCN(CC1)c1ncc(c(c1)C)Br)OC(C)(C)C
Complexity: __
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
HydrogenBondDonorCount: __
RotatableBondCount: __
UndefinedAtomStereocenterCount: __
Xlogp3: __
CatalogNumber:
__
ChemicalName:
__
CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
__
Smiles:
O=C(N1CCN(CC1)c1ncc(c(c1)C)Br)OC(C)(C)C
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
HydrogenBondDonorCount:
__
RotatableBondCount:
__
UndefinedAtomStereocenterCount:
__
Xlogp3:
__