AB44750
461-18-7 | 4,4,4-Trifluoro-1-butanol
Manufacturer: A2B Chem
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CatalogNumber
AB44750
ChemicalName
4,4,4-Trifluoro-1-butanol
CasNumber
461-18-7
MolecularFormula
C4H7F3O
MolecularWeight
128.093
MdlNumber
MFCD00041483
Smiles
OCCCC(F)(F)F
Complexity
58.8
Covalently-bondedUnitCount
1
HeavyAtomCount
8
HydrogenBondAcceptorCount
4
HydrogenBondDonorCount
1
RotatableBondCount
2
Xlogp3
0.9
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CatalogNumber: AB44750
ChemicalName: 4,4,4-Trifluoro-1-butanol
CasNumber: 461-18-7
MolecularFormula: C4H7F3O
MolecularWeight: 128.093
MdlNumber: MFCD00041483
Smiles: OCCCC(F)(F)F
Complexity: 58.8
Covalently-bondedUnitCount: 1
HeavyAtomCount: 8
HydrogenBondAcceptorCount: 4
HydrogenBondDonorCount: 1
RotatableBondCount: 2
Xlogp3: 0.9
CatalogNumber:
AB44750
ChemicalName:
4,4,4-Trifluoro-1-butanol
CasNumber:
461-18-7
MolecularFormula:
C4H7F3O
MolecularWeight:
128.093
MdlNumber:
MFCD00041483
Smiles:
OCCCC(F)(F)F
Complexity:
58.8
Covalently-bondedUnitCount:
1
HeavyAtomCount:
8
HydrogenBondAcceptorCount:
4
HydrogenBondDonorCount:
1
RotatableBondCount:
2
Xlogp3:
0.9
CatalogNumber: AB44751
ChemicalName: 5-Methylfuran-2-boronic acid, pinacol ester
CasNumber: 338998-93-9
MolecularFormula: C11H17BO3
MolecularWeight: 208.0619
MdlNumber: MFCD03094689
Smiles: Cc1ccc(o1)B1OC(C(O1)(C)C)(C)C
Complexity: 236
Covalently-bondedUnitCount: 1
HeavyAtomCount: 15
HydrogenBondAcceptorCount: 3
HydrogenBondDonorCount: __
RotatableBondCount: 1
Xlogp3: __
CatalogNumber:
AB44751
ChemicalName:
5-Methylfuran-2-boronic acid, pinacol ester
CasNumber:
338998-93-9
MolecularFormula:
C11H17BO3
MolecularWeight:
208.0619
MdlNumber:
MFCD03094689
Smiles:
Cc1ccc(o1)B1OC(C(O1)(C)C)(C)C
Complexity:
236
Covalently-bondedUnitCount:
1
HeavyAtomCount:
15
HydrogenBondAcceptorCount:
3
HydrogenBondDonorCount:
__
RotatableBondCount:
1
Xlogp3:
__
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: Brc1ccc(cc1)c1ccc(cc1)Br
Complexity: 145
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
HydrogenBondDonorCount: __
RotatableBondCount: __
Xlogp3: 5.7
CatalogNumber:
__
ChemicalName:
__
CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
__
Smiles:
Brc1ccc(cc1)c1ccc(cc1)Br
Complexity:
145
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
HydrogenBondDonorCount:
__
RotatableBondCount:
__
Xlogp3:
5.7
CatalogNumber: AB44753
ChemicalName: 4,4'-(Ethene-1,2-diyl)diphenol
CasNumber: 659-22-3
MolecularFormula: C14H12O2
MolecularWeight: 212.2439
MdlNumber: MFCD00016487
Smiles: Oc1ccc(cc1)C=Cc1ccc(cc1)O
Complexity: 197
Covalently-bondedUnitCount: 1
HeavyAtomCount: 16
HydrogenBondAcceptorCount: 2
HydrogenBondDonorCount: 2
RotatableBondCount: 2
Xlogp3: 3.5
CatalogNumber:
AB44753
ChemicalName:
4,4'-(Ethene-1,2-diyl)diphenol
CasNumber:
659-22-3
MolecularFormula:
C14H12O2
MolecularWeight:
212.2439
MdlNumber:
MFCD00016487
Smiles:
Oc1ccc(cc1)C=Cc1ccc(cc1)O
Complexity:
197
Covalently-bondedUnitCount:
1
HeavyAtomCount:
16
HydrogenBondAcceptorCount:
2
HydrogenBondDonorCount:
2
RotatableBondCount:
2
Xlogp3:
3.5