AB56471
321318-21-2 | 1-(3,4-Difluorophenyl)ethanol
Manufacturer: A2B Chem
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CatalogNumber
AB56471
ChemicalName
1-(3,4-Difluorophenyl)ethanol
CasNumber
321318-21-2
MolecularFormula
C8H8F2O
MolecularWeight
158.1453
MdlNumber
MFCD08442288
Smiles
CC(c1ccc(c(c1)F)F)O
Complexity
129
Covalently-bondedUnitCount
1
HeavyAtomCount
11
HydrogenBondAcceptorCount
3
HydrogenBondDonorCount
1
RotatableBondCount
1
UndefinedAtomStereocenterCount
1
Xlogp3
1.6
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CatalogNumber: AB56471
ChemicalName: 1-(3,4-Difluorophenyl)ethanol
CasNumber: 321318-21-2
MolecularFormula: C8H8F2O
MolecularWeight: 158.1453
MdlNumber: MFCD08442288
Smiles: CC(c1ccc(c(c1)F)F)O
Complexity: 129
Covalently-bondedUnitCount: 1
HeavyAtomCount: 11
HydrogenBondAcceptorCount: 3
HydrogenBondDonorCount: 1
RotatableBondCount: 1
UndefinedAtomStereocenterCount: 1
Xlogp3: 1.6
CatalogNumber:
AB56471
ChemicalName:
1-(3,4-Difluorophenyl)ethanol
CasNumber:
321318-21-2
MolecularFormula:
C8H8F2O
MolecularWeight:
158.1453
MdlNumber:
MFCD08442288
Smiles:
CC(c1ccc(c(c1)F)F)O
Complexity:
129
Covalently-bondedUnitCount:
1
HeavyAtomCount:
11
HydrogenBondAcceptorCount:
3
HydrogenBondDonorCount:
1
RotatableBondCount:
1
UndefinedAtomStereocenterCount:
1
Xlogp3:
1.6
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: CC(=O)c1ccc2c(c1)OCCCO2
Complexity: __
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
HydrogenBondDonorCount: __
RotatableBondCount: __
UndefinedAtomStereocenterCount: __
Xlogp3: __
CatalogNumber:
__
ChemicalName:
__
CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
__
Smiles:
CC(=O)c1ccc2c(c1)OCCCO2
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
HydrogenBondDonorCount:
__
RotatableBondCount:
__
UndefinedAtomStereocenterCount:
__
Xlogp3:
__
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: COc1cc(ccc1OC)C(O)C
Complexity: __
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
HydrogenBondDonorCount: __
RotatableBondCount: __
UndefinedAtomStereocenterCount: __
Xlogp3: __
CatalogNumber:
__
ChemicalName:
__
CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
__
Smiles:
COc1cc(ccc1OC)C(O)C
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
HydrogenBondDonorCount:
__
RotatableBondCount:
__
UndefinedAtomStereocenterCount:
__
Xlogp3:
__
CatalogNumber: AB56474
ChemicalName: Tonalide
CasNumber: 21145-77-7
MolecularFormula: C18H26O
MolecularWeight: 258.39843999999994
MdlNumber: MFCD00437355
Smiles: CC1CC(C)(C)c2c(C1(C)C)cc(c(c2)C(=O)C)C
Complexity: __
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
HydrogenBondDonorCount: __
RotatableBondCount: __
UndefinedAtomStereocenterCount: __
Xlogp3: __
CatalogNumber:
AB56474
ChemicalName:
Tonalide
CasNumber:
21145-77-7
MolecularFormula:
C18H26O
MolecularWeight:
258.39843999999994
MdlNumber:
MFCD00437355
Smiles:
CC1CC(C)(C)c2c(C1(C)C)cc(c(c2)C(=O)C)C
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
HydrogenBondDonorCount:
__
RotatableBondCount:
__
UndefinedAtomStereocenterCount:
__
Xlogp3:
__